Selected Publications
2026
Book Chapters
Hsu, C.; Wolf, M. (2026). Syngas-based Pathways for SAF: Fischer–Tropsch Synthesis. Sustainable Aviation Fuel – Production and Use. Ed.: L. Okonye, 327–362, Royal Society of Chemistry (RSC). doi:10.1039/9781837678723-00327
Journal Articles
Zhang, J.; Shen, H.; Chen, Z.; Zhao, P.; Song, S.; Jiang, H.; Wen, Y.; Yang, S.; Zhang, Q.; Zhang, H. (2026). Oleylamine‐Assisted Construction of Bi‐Bi
Takano, A.; Tischer, S.; Hodonj, D.; Lott, P.; Deutschmann, O.; Kusaka, J. (2026). Development of the Chemical Reaction Mechanism for Oxide Film Formation and Decomposition in Rh-Based Three-Way Catalysts. Emission Control Science and Technology, 12 (2), Art.Nr: 28. doi:10.1007/s40825-026-00311-z
Potter, M. E.; Sharapa, D. I.; Walerowski, M. G.; Cavaye, H.; Raja, R.; Armstrong, L.-M.; Carravetta, M.; Studt, F. (2026). Probing Ethanol Dehydration with Silicon-Doped Aluminophosphates under Realistic Working Conditions Using Inelastic Neutron Scattering and Infrared Measurements. ACS Catalysis. doi:10.1021/acscatal.6c02273
Sireci, E.; Hoffman, J.-A.; Sharapa, D. I.; Gambu, T. G.; van Steen, E.; Studt, F. (2026). Elucidating Mn Promoter Structures and Stability on Co Nanoparticles through a Machine Learning Potential-Powered Genetic Algorithm. ACS Catalysis. doi:10.1021/acscatal.6c04886
Ding, X.; Zhang, Q.; Doronkin, D. E.; Otroshchenko, T.; Fedorova, E. A.; Wang, D.; Bartling, S.; Lund, H.; Linke, D.; Kondratenko, E. V. (2026). Pt–(O)–Co Coordination Governs the Durability of Pt-Based Catalysts for Propane Dehydrogenation. EES Catalysis. doi:10.1039/D6EY00192K
Wörner, M. (2026). An Approximate Algebraic Model for Conversion and Light-off Curves by First-order Reactions in Monolith Converters Operated in the Graetz Regime. Emission Control Science and Technology, 12 (2), Art.Nr: 26. doi:10.1007/s40825-026-00307-9
Nazarlu, M. G.; Hafezi, S. M.; Ghorbannezhad, P.; Azizi, M. (2026). Life cycle assessment of MDF production: implementing bio-based production strategies. Clean Technologies and Environmental Policy, 28 (9), 233. doi:10.1007/s10098-026-03583-9
Baumgarten, L.; Kusumowidagdo, E.; Klag, L.; Schulte, M. L.; Bauer, E. N. O. A.; Zevaco, T. A.; Just, J.; Saraçi, E.; Grunwaldt, J.-D. (2026). Tuning Cu–Zn–Mg catalysts by flame spray pyrolysis for CO
Rieder, A.; Rabiee, H.; Lorenzutti, F.; Willi, P.; Warmuth, L.; Vesztergom, S.; Grass, R.; Stark, W.; Haussener, S.; Broekmann, P. (2026). Scalable flame spray-derived bismuth catalysts enable efficient CO
Kim, J.; Zhou, X.; Doronkinb, D. E.; Sarmac, B. B.; Dobrota, A. S.; Skorodumova, N. V.; Pašti, I. A.; Schmidt, J.; Schmuki, P. (2026). Pt Single‐Atom Catalysts on FTO for Optically Invisible pH‐Universal Hydrogen Evolution Electrodes. Advanced Energy Materials, Art.Nr: 71493. doi:10.1002/aenm.71493
Jiang, L.; Welzenbach, J.; Spielmann, J.; Wilhelm, H. M.; Hofmann, K.; Reinauer, F.; Grunwaldt, J.-D.; Albert, B.; Hess, C.; Kramm, U. I. (2026). Coupled Operando Mössbauer‐Raman Spectroscopic Analysis of Iron Molybdate Catalysts During Oxidative Dehydrogenation. ChemCatChem, 18 (15). doi:10.1002/cctc.70959
Liu, Q.; Han, S.; Xiong, D.; Li, Y.; Yang, Q.; Zhao, D.; Zhong, Y.; Wang, S.; Chen, Z.; Doronkin, D. E.; Zhang, L.; Xu, C.; Jiang, G. (2026). Co‐tuning the content of hydroxyl nests and b‐axis thickness of ZnOx/Silicalite‐1 for efficient propane dehydrogenation. AIChE Journal. doi:10.1002/aic.70587
Kühnpast, V.; Drexler, M.; Kräber, N.; Rohloff, F.; Zevaco, T. A.; Arnold, U.; Sauer, J. (2026). Synthesis and kinetic modeling of functionalized oxymethylene ethers (f-OMEs) based on lactic acid derivatives and formaldehyde. RSC Advances, 16 (39), 44303–44324. doi:10.1039/d6ra02965e
Bettini, O.; Da Roit, N.; De Giacinto, A.; Dolcet, P.; Bragaggia, G.; Grunwaldt, J.-D.; Behrens, S.; Gross, S. (2026). Ceria Nanostructures Obtained by Hydrothermal Synthesis: Exploring the Experimental Parameter Landscape for Precise Morphology and Size Control. European Journal of Inorganic Chemistry, 29 (25). doi:10.1002/ejic.70287
Araujo, A. C. C.; Rojas Salas, M.; Silva, W. R.; Margellou, A. G.; Triantafyllidis, K. S.; Wisniewski, A., Jr.; Funke, A. (2026). Comprehensive Characterization of Lignin Bio-Oils from Alkali and Kraft Lignin with Integrated 1 H NMR Spectral Modeling. Energy and Fuels, 40 (29), 15847–15857. doi:10.1021/acs.energyfuels.6c00906
Gaur, A.; Paripsa, S.; Förste, F.; Doronkin, D. E.; Malzer, W.; Schlesiger, C.; Kanngießer, B.; Lützenkirchen-Hecht, D.; Welter, E.; Grunwaldt, J.-D. (2026). Curating and sharing XAS data – Metadata and Scientific quality control. Scientific Data, 13 (1), 1118. doi:10.1038/s41597-026-07966-x
Sapronov, A. A.; Doronkin, D. E.; Grunwaldt, J.-D. (2026). Fine-tuning ab initio XANES spectra calculations using the Bayesian optimization algorithm. Journal of Synchrotron Radiation, 33 (5), 1455–1466. doi:10.1107/S1600577526006430
Maurer, F.; Salcedo, A.; Casapu, M.; Loffreda, D.; Beck, A.; Dolcet, P.; Aouine, M.; Epicier, T.; Loridant, S.; Vernoux, P.; Michel, C.; Grunwaldt, J.-D. (2026). Predicting Catalyst Performance From Pt/CeO2 Redispersion Kinetics. Angewandte Chemie International Edition, 65 (39). doi:10.1002/anie.4743891
He, Y.; Jiang, H.; Zhao, P.; Wen, Y.; Yang, S.; Zhang, Q.; Zhang, H. (2026). Construction of Cu-OV-Ce and Cu nanoparticle dual synergetic active sites for robust electrochemical CO2 reduction to CH4. Science China Chemistry, 69 (8), 4618–4625. doi:10.1007/s11426-025-3384-y
Bagheri, M.; Stumpf, B.; Weimar, L.; Roisman, I. V.; Hussong, J.; Wörner, M.; Marschall, H. (2026). Insights into the dynamics of crown splash using a phase-field interface capturing method. Computers & Fluids, 318, Article no: 107226. doi:10.1016/j.compfluid.2026.107226
Plessow, P. N.; Studt, F. (2026). Mechanistic insight into the formation of aromatics during the MTO process in H-SSZ-13 from DFT calculations. Catalysis Science & Technology, 16 (16), 5415–5424. doi:10.1039/d6cy00727a
Barthelmeß, A.; Engl, T.; Nagel, P.; Dittmeyer, R.; Rubin, M.; Wolf, M. (2026). Designing Carbon Nitride Modifications for Tuneable CN@Al
Campos Fraga, M. M.; Hirayama, D. E.; Moreira, R.; Telis, N. R.; Schmitt, C. C.; Funke, A.; Raffelt, K.; Dahmen, N. (2026). Ethanol quenching in fast-pyrolysis of sugarcane bagasse and straw: Implications for bio-oil hydrodeoxygenation. Biomass and Bioenergy, Art.Nr: 109774. doi:10.1016/j.biombioe.2026.109774
Braun, L.; Hagen, F. P.; Fedoryk, M.; Seitz, M.; Stelzner, B.; Trimis, D.; Grunwaldt, J.-D.; Doronkin, D. E. (2026). In situ mapping of iron oxidation in laminar metal fuel flames using X-ray absorption spectroscopy. Journal of Synchrotron Radiation, 33 (5), 1418–1427. doi:10.1107/S1600577526005904
Herzinger, E.; Berger, J.; Johner, N. P.; Auer, F.; Wolf, M. (2026). Performance of Pt-based catalysts in perhydro benzyltoluene dehydrogenation: From semi-batch screening to continuous operation. Reaction Chemistry & Engineering. doi:10.1039/D6RE00193A
Hagen, F. P.; Braun, L.; Doronkin, D. E.; Seitz, M.; Fedoryk, M.; Stelzner, B.; Grunwaldt, J.-D.; Trimis, D. (2026). In situ X-ray absorption spectroscopy and multispectral pyrometry for spatially resolved probing of iron oxide phase evolution and temperature in iron dust flames. Proceedings of the Combustion Institute, 42, 106244. doi:10.1016/j.proci.2026.106244
Hoffman, J.-A.; Sireci, E.; Gambu, T.; Sharapa, D. I.; Studt, F.; Steen, E. van. (2026). Bridging calculated charges and formal oxidation state of manganese oxides: a DFT/DFT+
Kannengießer, M. P.; Braun, L.; Hagen, F. P.; Seitz, M.; Mögerle, L.; Stelzner, B.; Grunwaldt, J.-D.; Doronkin, D. E.; Trimis, D. (2026). Real-time tracking of iron oxide particle reduction with hydrogen in a fluidized bed reactor. Proceedings of the Combustion Institute, 42, Art.Nr: 106010. doi:10.1016/j.proci.2026.106010
Stüber, A.; Sharapa, D. I.; Tuczek, F.; Studt, F. (2026). A Molecular Analogue of Cu/ZSM-5 Catalyzing the Monooxygenation of Hydrocarbons via a Mono μ-Oxo Dicopper Species. ACS Omega, 11 (26), 38636–38641. doi:10.1021/acsomega.6c00806
Bopp, M.; Häber, T.; Secchi, F.; Schulz, S.; Wegt, S.; Krüger, L.; Suntz, R.; Trimis, D.; Frohnapfel, B.; Jakirlić, S. (2026). Mean flow and turbulence anisotropy representation in a round jet impingement: Experiment, DNS and modeling. European Journal of Mechanics - B/Fluids, 120, Art.Nr: 204592. doi:10.1016/j.euromechflu.2026.204592
Häber, T.; Struzek, S.; Caulfield, L.; Wan, S.; Maurer, F.; Lott, P.; Nefedov, A.; Wöll, C.; Grunwaldt, J.-D.; Deutschmann, O. (2026). Time-Resolved Dynamics During the Initial Decline in Catalytic Activity of the CO + NO Reaction over Platinum – Elucidating the Role of NCO. Emission Control Science and Technology, 12 (1), 16. doi:10.1007/s40825-026-00297-8
Zhou, H.; Yu, T.; Zhang, S.; Jiang, Z.; Zhou, K.; Liu, Z.; Han, Q.; Wen, Y.; Wang, Y. (2026). Tailoring Solvation Sheaths and Interfacial Chemistry: A Review of Electrolyte Engineering for Highly Reversible Aqueous Zinc–Iodine Batteries. Molecules, 31 (12), Art.Nr: 2127. doi:10.3390/molecules31122127
Häber, T.; Moosmayer, S.; Secchi, F.; Raiola, M.; Gatti, D.; Trimis, D.; Suntz, R.; Frohnapfel, B. (2026). Spatially resolved heat transfer measurements of impinging jets on statistically rough surfaces using an infrared-based gradient sensor. Experimental Thermal and Fluid Science, 177, 111797. doi:10.1016/j.expthermflusci.2026.111797
Häber, T.; Cárdenas, C.; Vijayaraghavan, S.; Othman, I. B.; Zimina, A.; Maurer, F.; Grunwaldt, J.-D.; Deutschmann, O.; Lott, P. (2026). Performance enhancement of Pd-based selective ammonia oxidation catalysts through forced dynamic operation. Applied Catalysis B: Environment and Energy, 399, Art.Nr: 127073. doi:10.1016/j.apcatb.2026.127073
Neyyathala, A.; Jung, F.; Feldmann, C.; Barth, S.; Grunwaldt, J.-D.; Jevtovikj, I.; Schunk, S. A.; Dolcet, P.; Gross, S.; Hanf, S. (2026). Description of the dataset on alkoxycarbonylation catalyzed by supported palladium phosphide nanoparticles. Data in Brief, 67, 112995. doi:10.1016/j.dib.2026.112995
D’Ambrosio, A.; Oliveira Campos, B. L. de; Sauer, J.; Piemonte, V. (2026). Multi-stage direct synthesis of dimethyl ether: Integrated thermodynamic, economic and environmental assessment for process intensification. Chemical Engineering Journal, 542, 177914. doi:10.1016/j.cej.2026.177914
Jalalinejad, A.; Seyf, J. Y.; Funke, A.; Dahmen, N. (2026). Development of Bio-UNIFAC Group Contribution Model to Predict the Phase Equilibria of Bio-Oil-Related Mixtures. Industrial and Engineering Chemistry Research, 65 (21), 10885–10903. doi:10.1021/acs.iecr.6c00041
Xu, L.; Zhao, D.; Hu, C.; Li, Y.; Yang, Q.; Chi, K.; Wang, R.; Shi, D.; Doronkin, D. E.; Cui, G.; Zhou, M.; Liu, C.; Zhao, Z.; Kondratenko, E. V.; Zhang, Z.; Jiang, G. (2026). Synergistic effect of Zn species and ZSM-5 in bifunctional Zn-ZSM-5 for efficient conversion of n-butane. Journal of Catalysis, Art.Nr: 117017. doi:10.1016/j.jcat.2026.117017
Heck, S.-L.; Dolcet, P.; Nails, G.; Rösch, M.; Göbel, U.; Schichtel, N.; Eich, A.; Jelic, J.; Studt, F.; Casapu, M.; Grunwaldt, J.-D. (2026). The journey of rhodium in Al2O3-CeO2-ZrO2 supported three-way catalysts. Applied Catalysis B: Environment and Energy, 395, Article no: 126851. doi:10.1016/j.apcatb.2026.126851
Canavan, J. R.; Beck, A.; Dauenhauer, P. J. (2026). Catalytic resonance theory for the kinetic signatures of multiple wavelength photocatalysis. Cell Reports Physical Science, 7 (5), Art.Nr: 103306. doi:10.1016/j.xcrp.2026.103306
Chen, S.; Yu, Z.; Wang, J.; Jelic, J.; Li, W.; Studt, F.; Wang, Y.; Wöll, C. (2026). Outside Front Cover: Subsurface Stabilization of Interstitial Pt Atoms on CeO₂ (111): Rethinking Single‐Atom Catalyst Architectures. Angewandte Chemie International Edition, 65 (25). doi:10.1002/anie.2026-m1105080700
Hamidzadeh, Z.; Yeganeh, B.; Ghorbannezhad, P. (2026). Enhanced Production of Fatty Acid Methyl Esters And Biochar via Pyrolysis of Palm oil Biomass: an Experimental Analysis. Water, Air, & Soil Pollution, 237 (5), article number 314. doi:10.1007/s11270-025-09000-z
Gallego-Villada, L. A.; Pätsch, S.; Mäki-Arvela, P.; Efimov, A.; Doronkin, D. E.; Mazur, M.; Lastusaari, M.; Elvers, B. J.; Virtanen, P.; Kumar, N.; Tirri, T.; Schulzke, C.; Murzin, D. Y. (2026). Direct Oxidation of Methane to Methanol Using Copper Phthalocyanines as Precursors. Applied Catalysis B: Environment and Energy, Art.Nr: 126987. doi:10.1016/j.apcatb.2026.126987
Bendehiba, K.; Sarmah, S.; Pujol, E.; Nkeuya, D.; Neukum, D.; Truttmann, V.; Doronkin, D. E.; Romero, N.; Serp, P.; Grunwaldt, J.-D.; Sarma, B. B. (2026). In situ X-ray absorption and emission spectroscopy to understand the electron transfer-oxygen transfer reaction of vanadium polyoxomolybdate in homogeneous medium. Chemical Science, 17 (26), 13042–13054. doi:10.1039/D6SC02170K
Shang, M.; Ji, L.; Wen, Y.; Wang, T.; Wang, J.; Chen, Z.; Wang, S. (2026). A Bioinspired Strategy for Enhancing Nitrogen Fixation Using Hydrophobic Ionic Liquids. ACS Sustainable Chemistry & Engineering, 14 (13), 6528–6536. doi:10.1021/acssuschemeng.6c00773
Münzer, P.; Oliveira Campos, B. L. de; Arnold, U.; Sauer, J. (2026). Comparative techno-economic analysis of a directly coupled production of methanol and formalin as example for improved hydrogen management in the chemical industry. Energy Conversion and Management, 353, 121216. doi:10.1016/j.enconman.2026.121216
Beck, A.; Gordon, M. J.; Christopher, P. (2026). Distinct Kinetic Signatures of Photodesorption from Metal Nanoparticles. Journal of the American Chemical Society, 148 (7), 7024–7034. doi:10.1021/jacs.5c17718
Sen, K.; Schäfer, A.; Rosowski, F.; Sharapa, D. I.; Studt, F. (2026). Understanding the Selectivity of Selective Oxidation of Propane to Acrylic Acid on a Mo–Te–Nb–O M1 Catalyst Using Density Functional Theory. ACS Omega, 11543–11554. doi:10.1021/acsomega.5c09399
Rodrigues Niquini, G.; Herrera Delgado, K.; Pitter, S.; Sauer, J. (2026). Kinetics of CO₂ hydrogenation to methanol on Cu/ZnO/ZrO₂ based on an extensive dataset. Reaction Chemistry & Engineering, 11 (2), 381–391. doi:10.1039/d5re00330j
Chen, S.; Yu, Z.; Wang, J.; Jelic, J.; Li, W.; Studt, F.; Wang, Y.; Wöll, C. (2026). Stabilisierung von interstitiellen Platin‐Atomen unterhalb der CeO₂(111)‐ Oberfläche: Neue Ansätze für die Architektur von Einzelatom‐Katalysatoren. Angewandte Chemie, 138 (25). doi:10.1002/ange.202522372
Chen, S.; Yu, Z.; Wang, J.; Jelic, J.; Li, W.; Studt, F.; Wang, Y.; Wöll, C. (2026). Subsurface Stabilization of Interstitial Pt Atoms on CeO 2 (111): Rethinking Single‐Atom Catalyst Architectures. Angewandte Chemie International Edition, 65 (25). doi:10.1002/anie.202522372
Namdar Zangeneh, A.; Abbasi, M.; Ghorbannezhad, P. (2026). Enhancement of engineered biochar functionality through co-pyrolysis of municipal wastes over metal-doped catalysts. Biomass and Bioenergy, 213, 109383. doi:10.1016/j.biombioe.2026.109383
Zhang, Q.; Gao, M.; Kondratenko, V. A.; Otroshchenko, T.; Ding, X.; Doronkin, D. E.; Wang, D.; Li, D.; Zhao, D.; Kondratenko, E. V. (2026). Ultrasmall PtCo Intermetallic Compounds Confined in Silicalite-1 for Highly Productive Propane Dehydrogenation. ACS Catalysis, 16 (10), 8915–8927. doi:10.1021/acscatal.5c08288
Zhang, F.; Zhang, J.; Luo, L.; Jacob, F.; Tischer, S.; Luo, K. H.; Deutschmann, O.; Sui, R. (2026). Surface mechanism for catalytic oxidation of n-decane over platinum: An experimental and modeling study. Combustion and Flame, 289, 114997. doi:10.1016/j.combustflame.2026.114997
Pfennings, M.; Hoang, G. T.; Ganti, R. T.; Dutzi, J.; Arnold, U.; Sauer, J. (2026). Synthesis of Hydrocarbon Fuels From Dimethyl Ether Through Co‐Oligomerization of Olefins. Chemie Ingenieur Technik, 98 (5), 262–270. doi:10.1002/cite.70106
Ding, X.; Zhang, Q.; Doronkin, D. E.; Bartling, S.; Lund, H.; Wang, D.; Fedorova, E.; Kubis, C.; Kondratenko, E. V. (2026). The Promoting Effect of Mg on Propane Dehydrogenation over Co/Silicalite-1 Catalysts. ACS Catalysis, 16 (9), 8543–8554. doi:10.1021/acscatal.6c01078
Horsinka, S.; Weis, D.; Beeskow, P.; Langner, T.; Sauer, J.; Waldvogel, S. R. (2026). From technical HCH residues to industrial relevant vicinal dichlorinated compounds: Electrochemical chlorine transfer as a strategy for waste valorisation. Journal of Hazardous Materials, 508, 141851. doi:10.1016/j.jhazmat.2026.141851
Matsokin, N. A.; Kalinin, M.; Buchwald, A.; Werner, H.-J.; Fink, R. F.; Fink, K.; Sharapa, D. I. (2026). Revisiting acene dimers: A comprehensive theoretical study of a less explored conformer. The Journal of Chemical Physics, 164 (13). doi:10.1063/5.0324531
Gaur, A.; Abe, H.; Ishii, M.; Paripsa, S.; Grunwaldt, J.-D.; Lützenkirchen-Hecht, D. (2026). XAS databases and repositories – perspective and current status. Radiation Physics and Chemistry, 245, 113897. doi:10.1016/j.radphyschem.2026.113897
Oliveira, A. de; Lederle, F.; Memmel, P.; Hübner, E. G.; Wasserscheid, P.; Wolf, M.; Auer, F. (2026). Pt–Re dehydrogenation catalysts synthesized via solvent deficient precipitation. Catalysis Science & Technology, 16 (8), 2933–2945. doi:10.1039/d5cy01600b
Pasichnyk, M.; Schmitt, C.; Plank, M.; Kerst, K.; Wang, W.; Aiti, M. Al; Cuniberti, G.; Lerch, A.; Théato, P. (2026). PMMA/pPFPA membrane with low content of modified TiO
Wörner, M.; Lacerda de Oliveira Campos, B.; Hornung, U.; Dahmen, N. (2026). From pulp to aromatic products – Kinetic modeling of hydrothermal lignin depolymerization. Journal of Environmental Chemical Engineering, 14 (3), Art.-Nr. 122311. doi:10.1016/j.jece.2026.122311
Bachmann, L. J.; Dwivedi, J.; Lapkin, D.; Wang, B.; Schober, J.-C.; Hinsley, G. N.; Bernart, S.; Ngoi, K. H.; Rysov, R.; Dangwal Pandey, A.; Keller, T. F.; Vartanyants, I. A.; Stierle, A. (2026). In situ X-ray imaging of segregation and mixing in PtPd core–shell nanoparticles under methane oxidation conditions. Nanoscale, 18 (15), 8127–8137. doi:10.1039/d5nr05321h
Avdoshin, A.; Matsokin, N. A.; Huynh, T.-N.; Sharapa, D. I.; Fink, K.; Studt, F.; Wenzel, W.; Kozlowska, M. (2026). Multiscale kinetic model of ethylene oligomerization in Ni-NU-1000 metal-organic framework. npj Computational Materials, 12 (1), 124. doi:10.1038/s41524-026-02044-7
Vicente, H.; Plessow, P. N. (2026). Formaldehyde formation and its impact on the MTO initiation investigated with ab initio molecular dynamics simulations. Journal of Catalysis, 457, 116817. doi:10.1016/j.jcat.2026.116817
Herzinger, E.; Berger, J.; Wolf, M. (2026). Continuous dehydrogenation of perhydro benzyltoluene in a three-phase stirred tank slurry reactor. Chemical Engineering Journal, 534, 175168. doi:10.1016/j.cej.2026.175168
Tischer, S.; Deutschmann, O. (2026). Thermodynamic consistency of surface reaction mechanisms and its consequences for steady-state solutions. Combustion Theory and Modelling, 30 (5), 672–684. doi:10.1080/13647830.2026.2625145
Zimina, A.; Fadlalla, M. I.; Potgieter, J.; Jimenez, C. E.; Ilica, R.; Sireci, E.; Sharapa, D. I.; Oliveira, D. de; Hsu, C.; Saraci, E.; Wolf, M.; Sakoglu, P.; Skaltsogiannis, A.; Zhong, T.; Bär, M.; Botha, T.; Moodley, D.; Claeys, M.; Studt, F.; Grunwaldt, J.-D. (2026). Comparison of Industrially Relevant Fischer–Tropsch Cobalt Catalysts Supported on Alumina and Modified Silica with Complementary In-Situ and Operando Characterization Methods. The Journal of Physical Chemistry C, 130 (10), 3676–3690. doi:10.1021/acs.jpcc.5c05172
Braga, A.; Armengol-Profitós, M.; Pascua-Solé, L.; Soler, L.; Serrano, I.; Villar-Garcia, I. J.; Pérez-Dieste, V.; Tusini, E.; De Giacinto, A.; Zimina, A. V.; Grunwaldt, J.-D.; Llorca, J.; Divins, N. J. (2026). Mechanochemically Engineered Bimetallic PtNi/CeO
Zhang, Q.; Li, Y.; Tian, X.; Kondratenko, V. A.; Fedorova, E. A.; Yang, T.; Ding, X.; Doronkin, D. E.; Zhao, D.; Deng, C.; Chen, H.; Xu, S.; Zanina, A.; Bartling, S.; Otroshchenko, T.; Wang, Y.; Zhao, Z.; Xu, C.; Jiang, G.; Jiao, H.; Kondratenko, E. V. (2026). Mixed-valence Co
Lacerda de Oliveira Campos, B.; Dutzi, J.; Campos Fraga, M. M.; Vadarlis, A. A.; Sauer, J. (2026). Supercritical water gasification of lignocellulosic biomass: Kinetic modeling enhanced by Bayesian optimization. Chemical Engineering Journal, 530, Art.-Nr.: 173614. doi:10.1016/j.cej.2026.173614
Struzek, S.; Holtermann, B.; Sharma, S.; Maurer, F.; Jelic, J.; Zimina, A.; Studt, F.; Eggeler, Y. M.; Grunwaldt, J.-D. (2026). In Situ Tracking of Pt Migration from Pt/Al
Neyyathala, A.; Jung, F.; Feldmann, C.; Barth, S.; Grunwaldt, J.-D.; Jevtovikj, I.; Schunk, S. A.; Dolcet, P.; Gross, S.; Hanf, S. (2026). Carbonylation catalysis of aryl halides through active-site engineering. Journal of Catalysis, 456, Art.-Nr.: 116733. doi:10.1016/j.jcat.2026.116733
Fuchs, C.; Arnold, U.; Sauer, J. (2026). Synthesis of Gasoline and Kerosene by Heterogeneously Catalyzed (Co‐)Oligomerization of Ethylene, Propylene, and Iso‐Butylene. ChemCatChem, 18 (2). doi:10.1002/cctc.202501589
Baumgarten, L.; Hauberg, P.; Mangelsen, S.; Coppex, C.; Jelic, J.; Schulte, M. L.; Wolf, A.; Taetz, B.; Reller, H. K.; Saedimarghmaleki, M.; Studt, F.; Saraçi, E.; Just, J.; Behrens, M.; Grunwaldt, J.-D. (2026). Gallia‐ Versus Alumina‐Supported Cu: Dynamics of Ga in Catalysts for Green Methanol Production. ChemCatChem, 18 (2), 1. doi:10.1002/cctc.202501338
Angeli, S. D.; Xu, H.; Beger, T.; Titus-Emse, J.; Jentys, A.; Gläser, R.; Deutschmann, O. (2026). Modeling and Simulation of Combined CO
Araujo, A. C. C. D.; Fonseca, F. G.; Dahmen, N.; Funke, A. (2026). Assessing phase behavior of pyrolytic lignin in fast pyrolysis bio-oil via advanced distillation curve. Biomass and Bioenergy, 209, 109009. doi:10.1016/j.biombioe.2026.109009
Borgmann, L. M.; Priante, E.; Johnsen, S.; Schneider, M.; Guttmann, M.; Bläsi, B.; Wiegand, G.; Hölscher, H. (2026). Combined Foaming and Surface Structuring of Polymers With Supercritical Carbon Dioxide ( scCO
Vermaak, V.; Cunningham, R. D.; Potgieter, J. H.; Botha, J. M.; Steen, E. van; Claeys, M.; Fadlalla, M.; Hoffman, J.-A.; Abdullah, S.; Sireci, E.; Studt, F.; Zimina, A.; Grunwaldt, J.-D.; Hsu, C.; Wolf, M.; Jiménez, C.; Sakoglu, P.; Moodley, D. (2026). Manganese-enhanced Cobalt Catalysts for Fischer-Tropsch Synthesis: A review of structural and electronic promotion effects. Catalysis Science & Technology, 16 (5), 1488–1530. doi:10.1039/D5CY01467K
Maurer, L.; Warmuth, L.; Thiele, M.; Guse, D.; Kind, M.; Wasserscheid, P.; Pitter, S.; Wolf, M.; Auer, F. (2026). Improved Copper‐Zinc Based Catalysts for the Partial Dehydrogenation of Dicyclohexylmethanol. ChemCatChem, 18 (2). doi:10.1002/cctc.202501689
Beger, T.; Angeli, S. D.; Titus-Emse, J.; Deutschmann, O.; Gläser, R. (2026). CO
Warmuth, L.; Hofsäß, C.; Zevaco, T. A.; Schild, D.; Pitter, S.; Sauer, J. (2026). Investigation of methanol catalyst stability in presence of potential green hydrogen impurities. International Journal of Hydrogen Energy, 207, 153382. doi:10.1016/j.ijhydene.2026.153382
Liu, F.; He, L.; Ji, L.; Wen, Y.; Wang, T.; Wang, S. (2026). Bipolar Hydrogen Production from a Hybrid Alkaline‐Acidic Formaldehyde‐Proton Fuel Cell. Advanced Science. doi:10.1002/advs.202522899
Zhang, Q.; Zhang, T.; Liu, B.; Fedorova, E.; Doronkin, D. E.; Kondratenko, E. V. (2026). SSZ‐13 Zeolite with Isolated Co
Zhang, Q.; Zhang, T.; Liu, B.; Fedorova, E.; Doronkin, D. E.; Kondratenko, E. V. (2026). SSZ‐13‐Zeolith mit Isolierten Co
Häber, T.; Wan, S.; Struzek, S.; Cárdenas, C.; Zimina, A.; Maurer, F.; Lott, P.; Suntz, R.; Grunwaldt, J.-D.; Deutschmann, O. (2026). Novel advanced channel reactor for spatio-temporal activity and catalyst state correlations applied for the reduction of NO by CO over Pt/Al₂O₃. Applied Catalysis A: General, 712, 120748. doi:10.1016/j.apcata.2025.120748
Groppe, P.; Zimmermann, T.; Madubuko, N.; Bürner, K.; Sheng, Y.; Wichmann, C.; Moritz, M. S.; Czechowsky, J.; Müller, V.; Libuda, J.; Wasserscheid, P.; Mandel, K.; Daeneke, T.; Grunwaldt, J.-D.; Papp, C.; Haumann, M.; Retzer, T.; Taccardi, N.; Wintzheimer, S. (2026). The influence of GaPt droplet purification on the catalytic performance of supraparticles as supported catalytically active liquid metal solutions (SCALMS) in propane dehydrogenation. Journal of Materials Chemistry A, 14 (8), 4453–4467. doi:10.1039/D5TA08306K
Ebel, C. F. W.; Richter, L.; Minden, S.; Meurer, T.; Kaster, A.-K.; Wolf, M.; Sauer, J. (2026). Development and application of a predictive fermentation model for continuous and pressurized fermentation using Clostridium ljungdahlii. Chemical Engineering Journal, 527, 171744. doi:10.1016/j.cej.2025.171744
Monning, M.; Asadli, A.; Bajohr, S.; Wolf, M.; Kolb, T. (2026). Determination of reaction kinetics in three phase CO 2 methanation. Reaction Chemistry & Engineering, 11 (3), 723–730. doi:10.1039/D5RE00337G
De Giacinto, A.; Tusini, E.; Doronkin, D. E.; Reguer, S.; Popescu, R.; Grunwaldt, J.-D.; Casapu, M. (2026). Role of Mg:Al ratio and Pt promotion on mitigating the deactivation of Ni-based methane steam reforming catalysts. Applied Catalysis B: Environment and Energy, 385, 126305. doi:10.1016/j.apcatb.2025.126305
Wen, Y.; Li, W.; Sharapa, D. I.; Zevaco, T. A.; Schild, D.; Studt, F.; Raffelt, K.; Dahmen, N. (2026). Engineering Ni(0)/Ni(II) interfaces in LDH-Derived Ni–Al catalysts for mild lignin depolymerization. Bioresource Technology, 442, 133697. doi:10.1016/j.biortech.2025.133697
Pashminehazar, R.; Fam, Y.; Diaz, A.; Holler, M.; Kronenberg, M.; Ihli, johannes; Grunwaldt, J.-D.; Sheppard, T. L. (2026). Hard X-ray nanotomography reveals anomalous and expected thermal coarsening behaviour of nanoporous gold. Nanoscale Advances, 8 (2), 662–672. doi:10.1039/D5NA00561B
Schulte, M. L.; Truttmann, V.; Baumgarten, L.; Nicolai, A. G.; Montalvo Beltran, D. A.; Summ, F. J.; Kiener, C.; Saraçi, E.; Grunwaldt, J.-D. (2026). Spectroscopic Reactor for Operando Investigations Made by Additive Manufacturing for High‐Pressure Catalysis Applications. Chemistry–Methods, 6 (1). doi:10.1002/cmtd.202500105
Guci, M.; Knäbbeler-Buß, M.; Verkama, E.; Günthel, M.; Islam, M. R.; Kienle, L.; Saraçi, E.; Grunwaldt, J.-D.; Nestler, F. (2026). NH
Barthelmeß, A.; Wambo Tchatchou, A. J.; Zimmermann, M.; Trouillet, V.; Wolf, M. (2026). Activity Boost for Cobalt–Selectivity Shift and Activation During CO
Almeida De Campos, L.; Ciocci, P.; Schröder, J.; Sheppard, T. L. (2026). Advanced Characterization of Proton Exchange Membrane Water Electrolyzers with Spatially‐Resolved X‐Ray Imaging. ChemCatChem, 18 (1), Art.-Nr.: e00530. doi:10.1002/cctc.202500530
Seitz, M.; Kannengießer, M. P.; Stelzner, B.; Hagen, F. P.; Braun, L.; Kaltenbach, J.; Märkle, K.; Peterlechner, M.; Spielmann, J.; Doronkin, D. E.; Deutschmann, M. P.; Grunwaldt, J.-D.; Eggeler, Y. M.; Kramm, U. I.; Nirschl, H.; Trimis, D. (2026). Reduction of micron-sized iron oxide particles with high initial porosity in a fluidized bed reactor using hydrogen: Morphology and phase analysis. Fuel, 405, Art.-Nr.: 136422. doi:10.1016/j.fuel.2025.136422
Hollarek, D.; Schopmans, H.; Östreicher, J.; Teufel, J.; Cao, B.; Alwen, A.; Schweidler, S.; Singh, M.; Kodalle, T.; Hu, H.; Heymans, G.; Abdelsamie, M.; Hardiagon, A.; Wieczorek, A.; Zhuk, S.; Schwaiger, R.; Siol, S.; Coudert, F.-X.; Wolf, M.; Sutter-Fella, C. M.; Breitung, B.; Hodge, A. M.; Zhang, T.- yi; Friederich, P. (2026). opXRD: Open Experimental Powder X‐Ray Diffraction Database. Advanced Intelligent Discovery, 2 (2), 202500044. doi:10.1002/aidi.202500044
2025
Book Chapters
Brübach, L.; Wolf, M.; Pfeifer, P. (2025). Fischer-Tropsch Synthesis. Powerfuels: Status and Prospects. Ed.: N. Bullerdiek, 605–645, Springer Nature Switzerland. doi:10.1007/978-3-031-62411-7_22
Journal Articles
Huynh, T.-N.; Matsokin, N. A.; Studt, F.; Fink, K.; Sharapa, D. I. (2025). Ethylene Dimerization on Ni-Supported NU-1000: A Comprehensive Theoretical Study. The Journal of Physical Chemistry C, 129 (51), 22377–22389. doi:10.1021/acs.jpcc.5c05954
Maurer, M.; Popescu, R.; Störmer, H.; Casapu, M.; Grunwaldt, J.-D. (2025). The effect of support and promoters on the performance of Pt-based H2-SCR catalysts for NOx removal. Applied Catalysis B: Environment and Energy, 126347. doi:10.1016/j.apcatb.2025.126347
Sireci, E.; Sharapa, D. I.; Studt, F. (2025). A Comprehensive Overview of Active Sites of fcc-Co Nanoparticles and Their Role in CO Splitting─A DFT Study. The Journal of Physical Chemistry C, 129 (49), 21634–21641. doi:10.1021/acs.jpcc.5c07278
Vicente, H.; Huber, P.; Gayubo, A. G.; Studt, F.; Plessow, P. N. (2025). Reactivity of Pentamethylcyclopentenyl Cations toward Olefin Formation in the Methanol-to-Olefin (MTO) Process. The Journal of Physical Chemistry C, 129 (47), 20971–20980. doi:10.1021/acs.jpcc.5c07265
Bytyqi, H.; Mujdeci, G. N.; Ekici, E.; Ozturk, A. B.; Celik Madenli, E.; Kumar, G. (2025). Review of lignocellulosic bio-chemical production: Current challenges, advances, and future perspectives. Energy Nexus, 20, 100543. doi:10.1016/j.nexus.2025.100543
Paksoy, A. I.; Bobadilla, L. F.; Blay-Roger, R.; Merkouri, L.-P.; López-Flores, V.; Coppex, C.; Jelic, J.; Studt, F.; Ramirez Reina, T.; Odriozola, J. A.; Duyar, M. S. (2025). Evidence of ambient pressure methanol production on Ni-Ga-Ca dual function materials and dynamic restructuring effects on selectivity. Chemical Engineering Journal, 520, 164122. doi:10.1016/j.cej.2025.164122
Yu, X.; Rabiee, H.; Dutta, A.; Li, Y.; Szakály, Z.; Vesztergom, S.; Warmuth, L.; Rieder, A.; Broekmann, P. (2025). Upcycling CO
Ghule, S.; Korenkov, K. O.; Sharapa, D. I.; Amsharov, K. Y.; Kataev, E. A.; Oshchepkov, A. S. (2025). Naphthalimide‐Buckybowl Tweezer for Selective Recognition of Fullerene C
Huynh, T.-N.; Thi Minh Nguyet, N.; Ai, B. D.; Trung, N. T. (2025). Tetrel, nonconventional hydrogen bonds, and noticeable role of dispersion in complexes of fluoroform and carbon dichalcogenides. Physical Chemistry Chemical Physics, 27 (28), 14966–14975. doi:10.1039/d5cp01508a
Zhang, X.; Wang, W.; Yan, J.; Lu, Y.; Ghorbannezhad, P.; Li, Z.; Fu, P. (2025). Controlled alkylation of lignin-based aromatics over N-ZSM-5 catalysts for the production of C8-C15 aromatics in jet fuels. Energy Sources, Part A: Recovery, Utilization, and Environmental Effects, 47 (1), 10035–10046. doi:10.1080/15567036.2025.2496295
Parku, G. K.; Collard, F.-X.; Görgens, J. F. (2025). Pyrolysis of Waste Polypropylene Plastics for Energy Recovery: Optimization of Product Yield and Quality on a Commissioned Pilot-Scale Setup. Energy & Fuels, 39 (13), 6310–6318. doi:10.1021/acs.energyfuels.4c05902
Davari, S.; Chacko, R.; Bastek, T.; Lott, P.; Dailly, J.; Angeli, S.; Deutschmann, O. (2025). Experimental and microkinetic investigation of thermo-catalytic ammonia decomposition over a Ba-promoted Ru/Ni-BCZY catalyst for use in ammonia-fed protonic ceramic cells. Applied Catalysis A: General, 708, 120571. doi:10.1016/j.apcata.2025.120571
Lim, A.; Ham, K.; Quast, T.; Lee, S.; Tesch, M. F.; Czioska, S.; Ramermann, D.; Hetaba, W.; Schuhmann, W.; Grunwaldt, J.-D.; Cho, S. K.; Park, H.-Y.; Jang, J. H.; Ahn, S. H.; Spanos, I.; Park, H. S. (2025). Limited Surface Oxide Growth as a Prerequisite for Stabilizing Low-Loading Iridium Electrodes for PEM Water Electrolysis. ACS Catalysis, 15 (8), 6098–6113. doi:10.1021/acscatal.4c07864
Kalinina, E. A.; Kalinin, M. A.; Sharapa, D. I.; Maid, H.; Freidzon, A.; Haeri, H. H.; Hinderberger, D.; Dinnebier, R.; Oshchepkov, A. S.; Amsharov, K. Y. (2025). The Mystery of Dibenzoterrylene: a Clar‐interlocked Biphenalenyl Biradical. Chemistry – A European Journal, 31 (71), Art.-Nr.: e02952. doi:10.1002/chem.202502952
Rüde, T.; Strauch, D.; Szesni, N.; Wolf, M.; Wasserscheid, P.; Auer, F. (2025). Catalyst shape matters: Influence of catalyst shape on reactor performance in hydrogen release from perhydro benzyltoluene. International Journal of Hydrogen Energy, 191, 152174. doi:10.1016/j.ijhydene.2025.152174
Elwalily, A.; Verkama, E.; Mantei, F.; Kaliyeva, A.; Pounder, A.; Sauer, J.; Nestler, F. (2025). Sustainable aviation fuel production via the methanol pathway: a technical review. Sustainable Energy & Fuels, 9 (19), 5151–5180. doi:10.1039/d5se00231a
Bulsink, P.; Nguyen, L.; Gupta, M.; Collard, F.-X.; Funke, A.; Jeaidi, J.; Bronson, B. (2025). Interlaboratory Study of Sample Homogeneity Impact on CHNS, Water, and ICP Analysis of Biomass Liquefaction Oils. Energy & Fuels, 39 (29), 14223–14236. doi:10.1021/acs.energyfuels.5c01309
Freund, H.; Sauer, J.; Ehrhardt, K. (2025). Elektrifizierung der chemischen Industrie: Eine spannende Herausforderung entlang Skalen und Prozessketten. Chemie Ingenieur Technik, 97 (5), 363 – 363. doi:10.1002/cite.202500048
Warmuth, L.; Zevaco, T. A.; Guse, D.; Zimmermann, M.; Kind, M.; Pitter, S. (2025). Phase Transformation Processes in Coprecipitated Cu/Zn/Zr Methanol Catalyst Precursors—Insights into Suspension Aging Form Ultrafast Nucleation. ChemPlusChem, 90 (9), e202500284. doi:10.1002/cplu.202500284
Wörner, M. (2025). Dispersion and residence time distribution of laminar tubular flow in the transition regime – models for flow chemistry and beyond. Chemical Engineering Science, 318, 122116. doi:10.1016/j.ces.2025.122116
Huang, J.; Klahn, M.; Bartling, S.; Zimina, A. V.; Rockstroh, N.; Steinfeldt, N.; Peppel, T.; Grunwaldt, J.-D.; Strunk, J. (2025). Atomically Dispersed Palladium Promoted Suzuki–Miyaura Cross Coupling. ChemSusChem, 18 (20), e202500953. doi:10.1002/cssc.202500953
Sarasidis, V. C.; Dutzi, J.; Petsi, P. N.; Plakas, K. V.; Boukis, N.; Sauer, J. (2025). Decontamination of high salinity supercritical water gasification wastewater by an integrated electrocoagulation / electrochemical oxidation process. Journal of Environmental Chemical Engineering, 13 (5), 118491. doi:10.1016/j.jece.2025.118491
Plessow, P. N. (2025). Anharmonic Adsorption Free Energies and Apparent Activation Barriers for Mobile Reactants Based on Molecular Dynamics Simulations. Journal of Chemical Theory and Computation, 21 (17), 8518–8532. doi:10.1021/acs.jctc.5c01100
Sireci, E.; Grüger, T. D.; Plessow, P. N.; Sharapa, D. I.; Studt, F. (2025). Modeling the shape and stability of supported Co nanoparticles under Fischer–Tropsch conditions via DFT calculations and Monte Carlo simulations: insights into CO-driven surface reconstruction. Catalysis Science & Technology, 15 (22), 6703–6715. doi:10.1039/d5cy00921a
Zhang, F.; Wang, H.; Zhang, E.; Tischer, S.; Deutschmann, O.; Sui, R. (2025). Kinetic Insights into Ammonia Decomposition over Rhodium: A Combined Experimental, Modeling, and Theoretical Study. The Journal of Physical Chemistry C, 129 (40), 17955–17965. doi:10.1021/acs.jpcc.5c04975
Huynh, T.-N.; Mounssef, B., Jr.; Sharapa, D. I.; Studt, F.; Bučko, T. (2025). Anharmonic Correction to the Adsorption Free Energy of Oxygen-Containing Intermediates on Pt(111) by Machine-Learned Force Field-Based Thermodynamic Integrations. The Journal of Physical Chemistry C, 129 (37), 16742–16755. doi:10.1021/acs.jpcc.5c03465
Lacerda de Oliveira Campos, B.; Beeskow, P.; Drexler, M.; Herrera Delgado, K.; Arnold, U.; Sauer, J. (2025). Kinetic modeling and conceptual design of the OME synthesis from trioxane and dimethyl ether on H-ZSM-5. Chemical Engineering Science, 312, Art.-Nr.: 121655. doi:10.1016/j.ces.2025.121655
Enss, A. E.; Plessow, P. N.; Studt, F. (2025). A computational study on the formation mechanism of naphthalenic species under MTO conditions in H-SSZ-13. Catalysis Science & Technology, 15 (23), 7200–7208. doi:10.1039/d5cy00837a
Gyawali, P.; Shrestha, B.; Phanomsophon, T.; Posom, J.; Pornchaloempong, P.; Sirisomboon, P.; Shrestha, B. P.; Funke, A. (2025). Predicting biomass global warming potential with FT-NIR spectroscopy. Scientific Reports, 15 (1), Art.-Nr.: 33725. doi:10.1038/s41598-025-10584-z
Jägerfeld, P. J.; Gossler, H.; Riedel, J.; Angeli, S.; Wang, Y.; Bernart, S.; Jelic, J.; Studt, F.; Deutschmann, O. (2025). A Combined Infrared Spectroscopy Database and Analysis Tool. Chemie Ingenieur Technik, 97 (5), 463–471. doi:10.1002/cite.202400150
Düll, A.; Happ, A.; Buchmüller, J.; Ateş, C.; Börnhorst, M.; Häber, T.; Deutschmann, O. (2025). How structure-induced resonance waves intensify mass transfer in a falling film absorber for CO
Elwalily, A.; Verkama, E.; Mantei, F.; Kaliyeva, A.; Pounder, A.; Sauer, J.; Nestler, F. (2025). Correction: Sustainable aviation fuel production via the methanol pathway: a technical review. Sustainable Energy & Fuels, 9 (19), 5386–5386. doi:10.1039/d5se90062j
Naiara, T.; Mariana, C. F.; Thomas, Z.; Klaus, R.; Ricardo, S. (2025). NiFe Catalysts Supported on Nb
Liu, N.; Pham, T. M.; Han, Y.; Yang, L.; Bokareva, O. S.; Bartling, S.; Springer, A.; Spannenberg, A.; Kubis, C.; Weiss, J.; Doronkin, D. E.; Ju, W.; Francke, R. (2025). Heterogenized Copper(II) Phenanthroline Catalysts for Electroreduction of CO2 to C2 Compounds: Substitution on the Ligand Causes Structural Changes to the Molecular Framework and Stability Enhancement. Advanced Materials, Art.-Nr.: e13702. doi:10.1002/adma.202513702
Margellou, A. G.; Langschwager, F.; Pappa, C. P.; Araujo, A. C. C.; Funke, A.; Triantafyllidis, K. S. (2025). Solvolysis and Mild Hydrogenolysis of Lignin Pyrolysis Bio-Oils for Bunker Fuel Blends. Energies, 18 (14), Art.-Nr.: 3683. doi:10.3390/en18143683
Lausch, M.; Ruan, Y.; Brockmann, P.; Zimina, A.; Etzold, B. J. M.; Hussong, J. (2025). Influence of light, temperature, and iron oxidation state on the dissolution rate of combusted iron particles in oxalic acid. Results in Engineering, 27, 105851. doi:10.1016/j.rineng.2025.105851
Barth, S.; Zengel, D.; Goncalves, T. J.; Plessow, P. N.; Studt, F.; Grunwaldt, J.-D.; Casapu, M. (2025). Tailoring the active sites in Cu-SSZ-13 as a catalyst for the selective catalytic reduction of NH3 to minimize HCHO and HCN emissions. Nature Catalysis, 8, 804–821. doi:10.1038/s41929-025-01389-4
Savintseva, L.; Neugebauer, P.; Sharapa, D. I.; Röse, P.; Krewer, U.; Studt, F. (2025). The Electrochemical Shono Oxidation of N‐Formylpyrrolidine: Mechanistic Insights from the Computational Ferrocene Electrode Model and Cyclic Voltammetry. ChemElectroChem, 12 (19), Art.-Nr. e202500202. doi:10.1002/celc.202500202
De Giacinto, A.; Dolcet, P.; Wang, D.; Czechowsky, J.; Maliakkal, C. B.; Kübel, C.; Behrens, S.; Grunwaldt, J.-D.; Gross, S.; Casapu, M. (2025). Influence of the CeO
Gashnikova, D.; Struzek, S.; Maurer, F.; Bauer, M. R.; Maliakkal, C. B.; Kübel, C.; Casapu, M.; Grunwaldt, J.-D. (2025). Complementary and Spatially Resolved Operando Spectroscopic Investigation of Pt/Al2O3 and Pt/CeO2 Catalysts during CO/NO Conversion. The Journal of Physical Chemistry C. doi:10.1021/acs.jpcc.5c01963
Delrieux, T.; Sharma, S.; Maurer, F.; Czechowsky, J.; Borca, C. N.; Karpov, D.; Cárdenas, C.; Lott, P.; Casapu, M.; Sheppard, T. L.; Grunwaldt, J.-D. (2025). Tracking Sulfur Poisoning of Pd/Al2O3 Catalysts for Methane Oxidation on Different Complexity Scales. ACS Catalysis, 15 (15), 13470–13485. doi:10.1021/acscatal.5c02678
Amelung, L.; Barty, A.; Murphy, B. M.; Grunwaldt, J.-D.; Hövelmann, S.; Leonau, A.; Paripsa, S.; Schneidewind, A.; Busch, S.; Gutt, C.; Lohstroh, W.; Schreiber, F.; Unruh, T. (2025). DAPHNE4NFDI - Improving Research data management at Synchrotron Facilities. Journal of Physics: Conference Series, 3010 (1), 012133. doi:10.1088/1742-6596/3010/1/012133
Paripsa, S.; Gaur, A.; Förste, F.; Doronkin, D. E.; Malzer, W.; Schlesiger, C.; Kanngießer, B.; Welter, E.; Grunwaldt, J.-D.; Lützenkirchen-Hecht, D. (2025). RefXAS : an open access database of X-ray absorption spectra – improvements and outlook. Journal of Physics: Conference Series, 3010 (1), 012124. doi:10.1088/1742-6596/3010/1/012124
Araujo, A. C. C. de; Funke, A.; Margellou, A.; Triantafyllidis, K.; Dahmen, N. (2025). Pilot scale fast pyrolysis of lignin in a twin-screw reactor. Biomass and Bioenergy, 200, 108041. doi:10.1016/j.biombioe.2025.108041
Zhang, Q.; Kondratenko, V. A.; Ding, X.; Weiss, J.; Bartling, S.; Fedorova, E.; Zhao, D.; Doronkin, D. E.; Wang, D.; Kubis, C.; Kondratenko, E. V. (2025). Understanding the reaction-induced restructuring of CoOₓ species in silicalite-1 to control selectivity in non-oxidative dehydrogenation of propane. Chinese Journal of Catalysis, 74, 108–119. doi:10.1016/S1872-2067(25)64724-3
Biffar, L.; Brinker, N. M.; Pfeifer, P.; Dittmeyer, R.; Grunwaldt, J.-D.; Doronkin, D. E. (2025). Structure–Activity Relationships in RuCs/MgO Catalysts During Ammonia Synthesis. ChemSusChem, 18 (19), Art.-Nr.: 2501035. doi:10.1002/cssc.202501035
Sireci, E.; Grüger, T. D.; Plessow, P. N.; Sharapa, D. I.; Studt, F. (2025). Modeling the Shape and Stability of Co Nanoparticles as a Function of Size and Support Interactions through DFT Calculations and Monte Carlo Simulations. The Journal of Physical Chemistry C, 129 (29), 13232–13243. doi:10.1021/acs.jpcc.5c02777
Witzel, R.; Wildersinn, L.; Tusini, E.; Czioska, S.; Dorner, I.; Zimina, A.; Grunwaldt, J.-D.; Röse, P. (2025). Investigation of the performance and stability of copper and brass nanoparticles for CO₂ reduction in organic electrolytes. Journal of CO2 Utilization, 97, Article no: 103138. doi:10.1016/j.jcou.2025.103138
Barth, S.; Scheibe, L.; Casapu, M.; Grunwaldt, J.-D. (2025). Novel and more facile synthesis of highly dispersed iron in small-pore zeolites by ion exchange for catalytic applications. Chemical Communications, 61 (71), 13465–13468. doi:10.1039/D5CC02081F
Yousefi Seyf, J.; Zarei, F.; Jalalinejad, A. (2025). Valorization of Pharmaceutical Waste by Recovery of Active Pharmaceutical Ingredients from Expired or Unused Finished Pharmaceutical Products with Thermodynamic Modeling. Organic Process Research & Development, 29 (5), 1333–1344. doi:10.1021/acs.oprd.5c00093
Dutzi, J.; Vadarlis, A. A.; Boukis, N.; Sauer, J. (2025). Development and Parametrization of a Novel Reactor Concept for the Supercritical Water Gasification Process. Industrial and Engineering Chemistry Research, 64 (19), 9500–9517. doi:10.1021/acs.iecr.4c04267
Sauer, J.; Wachsen, O. (2025). Zirkularität – Die Herausforderung des Chemieingenieurwesens. Chemie Ingenieur Technik, 97 (6), 588–598. doi:10.1002/cite.202500009
Wolf, M.; Gradl, T.; Raseale, S.; Maliugin, A.; Raman, N.; Schühle, P.; Taccardi, N.; Claeys, M.; Sharapa, D. I.; Studt, F.; Fischer, N.; Haumann, M.; Wasserscheid, P. (2025). In‐Pt Supported Catalytically Active Liquid Metal Solutions for Propane Dehydrogenation – Role of Surface Acidity of Support. ChemCatChem, 17 (12), e202402096. doi:10.1002/cctc.202402096
Siegele, F.; Eckhard, J. F.; Masubuchi, T.; Goddard, G.; Schooss, D.; Sharapa, D. I.; Studt, F.; Tschurl, M.; Heiz, U. (2025). From C-H Bond Insertion to Hydrogen Atom Transfer: Tuning the Reaction Mechanisms of Methane Activation by the Oxidation of Ta₂⁺. Chemistry – A European Journal, 31 (32), e202500545. doi:10.1002/chem.202500545
Etzold, B. J. M.; Hungsberg, M.; Ebrahim-Moghaddam, M.; Herold, F.; Dahmen, N.; Studt, F. (2025). Energy Requirements for Sustainable Olefin Production From CO₂ via Electro‐ or Thermal Catalysis. Chemical Engineering & Technology, 48 (6). doi:10.1002/ceat.70034
Yang, Q.; Fedorova, E. A.; Cao, D.-B.; Saraçi, E.; Kondratenko, V. A.; Kreyenschulte, C. R.; Lund, H.; Bartling, S.; Weiß, J.; Doronkin, D. E.; Grunwaldt, J.-D.; Brückner, A.; Jiao, H.; Kondratenko, E. V. (2025). Understanding Mn-modulated restructuring of Fe-based catalysts for controlling selectivity in CO2 hydrogenation to olefins. Nature Catalysis, 8 (6), 595–606. doi:10.1038/s41929-025-01334-5
Abarca, J. A.; Warmuth, L.; Rieder, A.; Dutta, A.; Vesztergom, S.; Broekmann, P.; Irabien, A.; Díaz-Sainz, G. (2025). GDE Stability in CO
Wu, K.; Kondratenko, V. A.; Zhou, M.; Doronkin, D.; Bartling, S.; Zhang, Q.; Han, S.; Jia, X.; Liu, Q.; Xiong, D.; Xu, C.; Jiang, G.; Zhao, D.; Rodemerck, U.; Linke, D.; Kondratenko, E. V. (2025). The Role of Reducibility of PtGaO
Ekici, E.; Joka Yildiz, M.; Kalinowska, M.; Wang, J.; Yildiz, G. (2025). Co-pyrolysis of waste wind turbine blades in a molten polyolefin medium. Journal of Analytical and Applied Pyrolysis, 190, 107143. doi:10.1016/j.jaap.2025.107143
Chacko, R.; Keller, K.; Shirsath, A. B.; Angeli, S.; Lott, P.; Deutschmann, O. (2025). Microkinetic Modeling of Support Effects in PdO-Based Methane Oxidation Catalysts. ACS Catalysis, 15 (9), 6937 – 6952. doi:10.1021/acscatal.5c00516
Bala, E.; Hornung, U.; Dahmen, N. (2025). Hydrothermal Liquefaction (HTL) of Lignin: The Adsorption Separation of Catechol Guaiacol and Phenol. Energies, 18 (9), 2181. doi:10.3390/en18092181
Wen, Y.; Zormpa, F.; Sharapa, D. I.; Studt, F.; Raffelt, K.; Dahmen, N. (2025). Exploring the hydrodeoxygenation of lignin β-O-4 dimer model compound and bio-oil by DFT and experimental studies. Molecular Catalysis, 580, 115134. doi:10.1016/j.mcat.2025.115134
Zormpa, F.; Treu, P.; Saraçi, E. (2025). Advancing biomass valorization with zeolite catalysts: Focus on oxidative transformations. Sustainable Chemistry for the Environment, 10, 100249. doi:10.1016/j.scenv.2025.100249
Vajglová, Z.; Mäki-Arvela, P.; Yevdokimova, O.; Martinez-Klimov, M.; Simakova, I.; Eränen, K.; Tirri, T.; van Hoeven, J. E. S.; Peuronen, A.; Huš, M.; Likozar, B.; Lastusaari, M.; Lindén, J.; Doronkin, D. E.; Murzin, D. Y. (2025). Effect of catalyst support on dihydroeugenol hydrodeoxygenation on low cost FeNi catalyst to produce renewable alkane fuel. Applied Catalysis A: General, 701, Aricle no: 120307. doi:10.1016/j.apcata.2025.120307
Ioannidou, G.; Drexler, M.; Arnold, U.; Sauer, J.; Lemonidou, A. A. (2025). One step erythritol hydrodeoxygenation towards green butadiene over mixed molybdenum-rhenium supported catalysts. Applied Catalysis A: General, 698, 120234. doi:10.1016/j.apcata.2025.120234
Struzek, S.; Delrieux, T.; Maurer, F.; Gonçalves, D. S.; Heck, S.-L.; Klag, L.; Czechowsky, J.; Zimina, A.; Grunwaldt, J.-D. (2025). Role of powders and coatings for relating catalytic activity and structure of Pt in emission control catalysis. Reaction Chemistry & Engineering. doi:10.1039/D4RE00262H
Drexler, M.; Zaghini Francesconi, V.; Arnold, U.; Zevaco, T. A.; Sauer, J. (2025). Production of oxymethylene ethers (OME) as sustainable diesel fuel substitutes: continuous synthesis from dimethyl ether and trioxane and evaluation of catalyst stability. RSC Sustainability, 3 (4), 1941–1956. doi:10.1039/D4SU00818A
Chowdhury, C.; Studt, F.; Jelic, J. (2025). Metal–Support Interactions in Metal/Oxide and Inverse Oxide/Metal Catalysts: A Case Study Using Cu/ZnO and ZnO/Cu Model Catalysts. The Journal of Physical Chemistry C, 129 (12), 5860–5867. doi:10.1021/acs.jpcc.4c08821
Niethammer, B.; Zormpa, F.; Hoang, G. T.; Slaby, N. A.; Zevaco, T. A.; Karakoulia, S.; Arnold, U.; Sauer, J. (2025). Conversion of dimethyl ether to hydrocarbons catalyzed by Pd-loaded *MRE zeolites. Catalysis Today, 453, 115258. doi:10.1016/j.cattod.2025.115258
Vadarlis, A. A.; Neukum, D.; Dutzi, J.; Lemonidou, A. A.; Boukis, N.; Sauer, J. (2025). Supercritical water gasification and subsequent steam reforming of the product gas under elevated temperature and pressure. International Journal of Hydrogen Energy, 111, 567 – 580. doi:10.1016/j.ijhydene.2025.02.197
Rojas, M.; Fonseca, F. G.; Hornung, U.; Funke, A.; Dahmen, N. (2025). Synthetic Lignin Oligomers: Analytical Techniques, Challenges, and Opportunities. ChemSusChem, 18 (10). doi:10.1002/cssc.202402334
Düll, A.; Lehmann, J.; Börnhorst, M.; Ateş, C.; Häber, T.; Deutschmann, O. (2025). Spatio-temporal characterization of the three-dimensional wave dynamics in falling film flows over rectangular corrugations. Experiments in Fluids, 66 (4), 71. doi:10.1007/s00348-025-03978-2
Fedorova, E. A.; Fedorov, A.; Doronkin, D. E.; Linke, D.; Kubis, C.; Brückner, A.; Kondratenko, E. V. (2025). Revealing the Mechanism and Kinetics of Fe 5 C 2 Formation From Ferrous Oxalate under CO 2 Fischer‐Tropsch Conditions Using Time‐Resolved In Situ X‐Ray Absorption Spectroscopy. Chemistry–Methods, 5 (5). doi:10.1002/cmtd.202400058
Gojare, S.; Chen, S.; Chen, J.; Yu, Z.; Vazquez Quesada, J.; Pleßow, P.; Fink, K.; Wang, Y. (2025). Adsorption of CO on α‐Al2O3(0001): A combined experimental and computational study. ChemPhysChem. doi:10.1002/cphc.202401134
Wörner, M.; Hornung, U.; Karagöz, S.; Zevaco, T.; Dahmen, N. (2025). Focus on hydrochars produced from hydrothermal liquefaction of beech wood, soda lignin and black liquor. European Journal of Wood and Wood Products, 83 (2), 61. doi:10.1007/s00107-025-02214-2
Treu, P.; Iltsiou, D.; Elbuga-Ilica, R.; Maliakkal, C.; Kegnæs, S.; Saraçi, E. (2025). Enhancing the oxidative cleavage of vicinal diols on Fe-ZSM-5 catalysts with hierarchical porosity. Sustainable Chemistry for the Environment, Article no: 100232. doi:10.1016/j.scenv.2025.100232
George, G.; Sharapa, D. I.; Stasyuk, A. J.; Poater, A.; Solà, M.; Posada-Pérez, S. (2025). Surface engineering for enhanced perovskite solar cells: Fullerene-mediated trap state formation on CsPbI3 (001) surface. Solar Energy Materials and Solar Cells, 283, 113441. doi:10.1016/j.solmat.2025.113441
Wang, B.; Yu, Z.; Chen, S.; Da Roit, N.; Schild, D.; Zimmermann, M.; Wang, Y.; Behrens, S. (2025). Single‐Step Synthesis of Dimethyl Ether from Syngas over Nanoparticle‐Derived Bifunctional Pd/CeO2/Al2O3 Catalysts. Angewandte Chemie International Edition, 64 (16), Art.-Nr.: e202423273. doi:10.1002/anie.202423273
Lazaar, N.; Wu, S.; Qin, S.; Hamrouni, A.; Bikash Sarma, B.; Doronkin, D. E.; Denisov, N.; Lachheb, H.; Schmuki, P. (2025). Single‐Atom Catalysts on C₃N₄ : Minimizing Single Atom Pt Loading for Maximized Photocatalytic Hydrogen Production Efficiency. Angewandte Chemie International Edition, 64 (6), e202416453. doi:10.1002/anie.202416453
Xing, X.; Cao, W.; Yan, J.; Zhang, Y.; Ghorbannezhad, P.; Li, Z.; Fu, P. (2025). Conversion of Lignin to Cyclohexanol via Mild Catalytic Depolymerization Coupled with Hydrogenation. Journal of Environmental Chemical Engineering, 13 (1), 115082. doi:10.1016/j.jece.2024.115082
Chakraborty, P.; Neumaier, M.; Seibel, J.; Da Roit, N.; Böttcher, A.; Schmitt, C.; Wang, D.; Kübel, C.; Behrens, S.; Kappes, M. M. (2025). Exploring the Activation of Atomically Precise [Pt
Tajoli, F.; Dolcet, P.; Claas, S.; Maliakkal, C. B.; Wang, D.; Kübel, C.; Casapu, M.; Fröba, M.; Grunwaldt, J.-D.; Gross, S. (2025). Confining the Synthesis of Palladium Nanoparticles in Mesoporous Silicas for CO Oxidation: The Role of the Support. ACS Applied Nano Materials, 8 (7), 3289–3303. doi:10.1021/acsanm.4c05689
Yousefi Seyf, J.; Nasrollahi, B.; Jalalinejad, A. (2025). Development of the Wilson Functional Activity Coefficient Model Using High-Quality and Critically Evaluated Phase Equilibria Data. Industrial & Engineering Chemistry Research, 64 (1), 888–900. doi:10.1021/acs.iecr.4c03712
Jeyalakshmi, V.; Wu, S.; Qin, S.; Zhou, X.; Sarma, B. B.; Doronkin, D. E.; Kolařík, J.; Šoóš, M.; Schmuki, P. (2025). Pd single atoms on g-C 3 N 4 photocatalysts: minimum loading for maximum activity. Chemical Science, 16 (11), 4788–4795. doi:10.1039/D4SC08589B
Rojas, M.; Manrique, R.; Hornung, U.; Funke, A.; Mullen, C. A.; Chejne, F.; Maya, J. C. (2025). Advances and challenges on hydrothermal processes for biomass conversion: Feedstock flexibility, products, and modeling approaches. Biomass and Bioenergy, 194, 107621. doi:10.1016/j.biombioe.2025.107621
Zaghini Francesconi, V.; Drexler, M.; Zevaco, T. A.; Arnold, U.; Sauer, J. (2025). Modified Oxymethylene Ethers Based on Technical Alcohol Mixtures and their Fuel Properties. Chemie Ingenieur Technik, 97 (5), 495–507. doi:10.1002/cite.202400159
Schulte, M. L.; Truttmann, V.; Doronkin, D. E.; Baumgarten, L.; Nicolai, A.; Beltran, D. A. M.; Summ, F. J.; Kiener, C.; Warmuth, L.; Pitter, S.; Saraçi, E.; Grunwaldt, J.-D. (2025). Monitoring the Fate of Zn in the Cu/ZnO/ZrO
Makhmutov, D.; Fedorova, E.; Zanina, A.; Kubis, C.; Zhao, D.; Doronkin, D.; Rockstroh, N.; Bartling, S.; Armbruster, U.; Wohlrab, S.; Kondratenko, E. V. (2025). Reaction Pathways of Methanol Formation in CO 2 Hydrogenation over Pd-Based Catalysts. ACS Catalysis, (15), 2328–2341. doi:10.1021/acscatal.4c07462
Falkner, S.; Maliakkal, C. B.; Liebertseder, M.; Czechowsky, J.; Casapu, M.; Grunwaldt, J.-D.; Kübel, C.; Feldmann, C. (2025). High-porosity Pt–CeO₂ nanosponges as oxidation catalyst. Nanoscale Advances, 7 (4), 1173–1182. doi:10.1039/d4na00525b
Naim, W.; Treu, P.; Dohrn, M.; Saraçi, E.; Grunwaldt, J.-D.; Fendt, S.; Spliethoff, H. (2025). Structure-Reactivity- and Modelling-Relationships during Thermal Annealing in Biomass Entrained-Flow Gasification: The Effect of Temperature and Residence Time. Fuel, 383, Art.-Nr.: 133848. doi:10.1016/j.fuel.2024.133848
Warmuth, L.; Zevaco, T. A.; Pitter, S. (2025). In situ FT-IR reveals ageing phenomena in the formation of a Cu/Zn/Zr methanol catalyst precursor. Inorganic Chemistry Communications, 172, Art.-Nr.: 113753. doi:10.1016/j.inoche.2024.113753
Mahayni, Y.; Maurer, L.; Baumeister, I.; Auer, F.; Wasserscheid, P.; Wolf, M. (2025). Batch and continuous synthesis of well‐defined Pt/Al2O3 catalysts for the dehydrogenation of homocyclic LOHCs. ChemCatChem, 17 (6), Art.-Nr.: e202401762. doi:10.1002/cctc.202401762
Fuchs, C.; Arnold, U.; Sauer, J. (2025). Synthesis of sustainable aviation fuels via (co–)oligomerization of light olefins. Fuel, 382, 133680. doi:10.1016/j.fuel.2024.133680
Neyyathala, A.; Fako, E.; De, S.; Gashnikova, D.; Maurer, F.; Grunwaldt, J.-D.; Schunk, S. A.; Hanf, S. (2025). From Poison to Promotor: Spatially Isolated Metal Sites in Supported Rhodium Sulfides as Hydroformylation Catalysts. Small Structures, 6 (1), 2400260. doi:10.1002/sstr.202400260
Rago, V.; Fernandes, T.; Mohr, M. (2025). Identifying Key Training Load and Intensity Indicators in Ice Hockey Using Unsupervised Machine Learning. Research Quarterly for Exercise and Sport, 96 (1), 21–33. doi:10.1080/02701367.2024.2360162
Schulte, M. L.; Sender, V. C.; Baumgarten, L.; Beck, A.; Nilayam, A. R. L.; Saraçi, E.; Grunwaldt, J.-D. (2025). Tuning Flame Spray Pyrolysis for Variation of the Crystallite Size in Cu/ZnO/ZrO
Silva, W. R.; Santos, T. M.; Carregosa, J. C.; Schmitt, C. C.; Raffelt, K.; Dahmen, N.; Wisniewski, A., Jr. (2025). Correction to: Bio-oil as a source of renewable chemicals: the chemistry of pyrolytic lignin. Biomass Conversion and Biorefinery, 15 (4), 5419–5420. doi:10.1007/s13399-024-05756-2
Shirsath, A. B.; Mokashi, M.; Pashminehazar, R.; Çelik, A.; Lott, P.; Tischer, S.; Grunwaldt, J.-D.; Deutschmann, O. (2025). Investigating the formation of soot in CH4 pyrolysis reactor: A numerical, experimental, and characterization study. Carbon, 231, Art.-Nr.: 119689. doi:10.1016/j.carbon.2024.119689
Sen, U.; Fonseca, F. G.; Chi, Y.; Pereira, H.; Funke, A. (2025). Fast pyrolysis of the waste lignocellulosic phloem fraction of Quercus cerris bark in a twin-screw reactor. Biomass Conversion and Biorefinery, 15 (7), 10251–10260. doi:10.1007/s13399-024-05921-7
Silva, W. R.; Santos, T. M.; Carregosa, J. C.; Schmitt, C. C.; Raffelt, K.; Dahmen, N.; Wisniewski, A., Jr. (2025). Bio-oil as a source of renewable chemicals: the chemistry of pyrolytic lignin. Biomass Conversion and Biorefinery, 15 (4), 5401–5418. doi:10.1007/s13399-024-05622-1
2024
Journal Articles
Chen, S.; Pleßow, P. N.; Yu, Z.; Sauter, E.; Caulfield, L.; Nefedov, A.; Studt, F.; Wang, Y.; Wöll, C. (2024). Struktur und chemische Reaktivität von Yttrium‐stabilisierten ZrO₂‐Oberflächen: Zur Bedeutung für die Wassergas‐Shift‐Reaktion. Angewandte Chemie, 136 (27), e202404775. doi:10.1002/ange.202404775
Kramarenko, A. S.; Sharapa, D. I.; Pidko, E. A.; Studt, F. (2024). Ab Initio Kinetics of Electrochemical Reactions Using the Computational Fc 0 /Fc + Electrode. The Journal of Physical Chemistry A, 128 (41), 9063–9070. doi:10.1021/acs.jpca.4c04923
Niksirat, M.; Aeenjan, F.; Pierantozzi, M.; Jalalinejad, A.; Khosharay, S. (2024). Modeling the viscosity of (water + methanol), (water + ethanol), (water + 1-propanol) and (water + 2-propanol) mixture up to the high pressures. Brazilian Journal of Chemical Engineering, 42 (4), 1673–1692. doi:10.1007/s43153-024-00515-2
Vázquez Quesada, J.; Bernart, S.; Studt, F.; Wang, Y.; Fink, K. (2024). CO adsorption on CeO2(111): A CCSD(T) benchmark study using an embedded-cluster model. The Journal of Chemical Physics, 161 (22). doi:10.1063/5.0231189
Saini, S.; Halldin Stenlid, J.; Deo, S.; Plessow, P. N.; Abild-Pedersen, F. (2024). A First-Principles Approach to Modeling Surface Site Stabilities on Multimetallic Catalysts. ACS Catalysis, 14 (2), 874–885. doi:10.1021/acscatal.3c04337
Virt, M.; Zaghini Francesconi, V.; Drexler, M.; Arnold, U.; Sauer, J.; Zöldy, M. (2024). An Artificial Intelligence Approach to Predict Physical Properties of Liquid Hydrocarbons. Periodica Polytechnica Chemical Engineering, 68 (4), 561 – 570. doi:10.3311/PPch.38160
Lausch, M.; Zimina, A.; Bao, J.; Pashminehazar, R.; Etzold, B. J. M.; Kramm, U. I.; Grunwaldt, J.-D.; Hussong, J. (2024). New insights into the dissolution mechanisms of iron oxides and combusted iron particles in oxalic acid. The Journal of Chemical Physics, 161 (19), 194308. doi:10.1063/5.0229410
Jordt, P.; Osterhoff, M.; Tymoshenko, Y.; Hakim, B.; Dolcet, P.; Maurer, F.; Biniyaminov, V.; Amelung, L.; Dall’Antonia, F.; Grunwaldt, J.-D.; Weber, F.; Lohstroh, W.; Murphy, B. M. (2024). Specifications for Electronic Laboratory Notebooks (ELN) in the Photon and Neutron Community. Synchrotron Radiation News, 37 (6), 3–8. doi:10.1080/08940886.2024.2432265
Davari, S.; Cárdenas, C.; Hettel, M.; Lott, P.; Tischer, S.; Angeli, S.; Deutschmann, O. (2024). Spatially Resolved Measurements in a Stagnation‐Flow Reactor: Kinetics of Catalytic NH 3 Decomposition. Chemie Ingenieur Technik, 96 (12), 1735–1750. doi:10.1002/cite.202400100
Liccardo, G.; Cendejas, M. C.; Mandal, S. C.; Stone, M. L.; Porter, S.; Nhan, B. T.; Kumar, A.; Smith, J.; Plessow, P. N.; Cegelski, L.; Osio-Norgaard, J.; Abild-Pedersen, F.; Chi, M.; Datye, A. K.; Bent, S. F.; Cargnello, M. (2024). Unveiling the Stability of Encapsulated Pt Catalysts Using Nanocrystals and Atomic Layer Deposition. Journal of the American Chemical Society, 146 (34), 23909–23922. doi:10.1021/jacs.4c06423
Wang, B.; Da Roit, N.; Zimmermann, M.; Boese, M.; Zevaco, T.; Behrens, S. (2024). Bifunctional catalysts based on PdZn/ZnO and hierarchical zeolites in the direct synthesis of dimethyl ether from CO-rich syngas: influence of the support and the Zn/Pd molar ratio. Catalysis Science & Technology, 14 (24), 7152–7162. doi:10.1039/D4CY00860J
Ekici, E.; Yildiz, G.; Yildiz, M. J.; Kalinowska, M.; Şeker, E.; Wang, J. (2024). Continuous flow pyrolysis of virgin and waste polyolefins: a comparative study, process optimization and product characterization. Frontiers of Chemical Science and Engineering, 18 (6), Art.-Nr.: 70. doi:10.1007/s11705-024-2429-x
Dolling, D. S.; Chen, J.; Schober, J.-C.; Creutzburg, M.; Jeromin, A.; Vonk, V.; Sharapa, D. I.; Keller, T. F.; Plessow, P. N.; Noei, H.; Stierle, A. (2024). Probing Active Sites on Pd/Pt Alloy Nanoparticles by CO Adsorption. ACS Nano, 18 (45), 31098–31108. doi:10.1021/acsnano.4c08291
Kuhn, C.; Knapp, A.; Deutschmann, M. P.; Spielmann, J.; Tischer, S.; Kramm, U. I.; Nirschl, H.; Deutschmann, O. (2024). Iron as Recyclable Metal Fuel: Unraveling Oxidation Behavior and Cyclization Effects Through Thermogravimetric Analysis, Wide‐Angle X‐ray Scattering and Mössbauer Spectroscopy. ChemSusChem, 17 (15), e202400351. doi:10.1002/cssc.202400351
Chen, J.; Sharapa, D. I.; Plessow, P. N. (2024). Stability of Hydroxylated α-Fe
Potter, M. E.; Spiske, L.; Plessow, P. N.; McShane, E. B.; Carravetta, M.; Oakley, A. E.; Bere, T.; Carter, J. H.; Vandegehuchte, B. D.; Kaźmierczak, K. M.; Studt, F.; Raja, R. (2024). Combining computational and experimental studies to gain mechanistic insights for n -butane isomerisation with a model microporous catalyst. Catalysis Science & Technology, 14 (24), 7140–7151. doi:10.1039/d4cy01035c
Minden, S.; Grünberger, A.; van der Schaaf, U.; Neumann, A.; Rösch, C.; Sauer, J.; Kaster, A.-K. (2024). Producing food from CO2 using microorganisms: Lots to do, little to lose!. Trends in Food Science & Technology, 154, Article no: 104778. doi:10.1016/j.tifs.2024.104778
Salas, M. R.; Fonseca, F. G.; de Araujo, A. C. C.; García-Perez, M.; Funke, A. (2024). Liquid–Liquid Equilibrium Prediction in Fast Pyrolysis Bio-Oil Systems: A Framework for Incorporating Bio-Oil Complexity. Energy & Fuels, 38 (19), 18769–18780. doi:10.1021/acs.energyfuels.4c03387
Gashnikova, D.; Maurer, F.; Bauer, M. R.; Bernart, S.; Jelic, J.; Lützen, M.; Maliakkal, C. B.; Dolcet, P.; Studt, F.; Kübel, C.; Damsgaard, C. D.; Casapu, M.; Grunwaldt, J.-D. (2024). Lifecycle of Pd Clusters: Following the Formation and Evolution of Active Pd Clusters on Ceria During CO Oxidation by In Situ/Operando Characterization Techniques. ACS Catalysis, 14 (19), 14871–14886. doi:10.1021/acscatal.4c02077
Düll, A.; Cros-Le Lagadec, A.; Buchmüller, J.; Häber, T.; Ates̗ C.; Börnhorst, M. (2024). Intensifying interfacial oscillations in falling film flows over rectangular corrugations. Physics of Fluids, 36 (9), Art.-Nr.: 092107. doi:10.1063/5.0222760
Wang, Y.; Denisov, N.; Qin, S.; Gonçalves, D. S.; Kim, H.; Sarma, B. B.; Schmuki, P. (2024). Stable and Highly Active Single Atom Configurations for Photocatalytic H 2 Generation. Advanced Materials, 36 (25), Art.-Nr.: 2400626. doi:10.1002/adma.202400626
Klag, L.; Gläser, R.; Krewer, U.; Reuter, K.; Grunwaldt, J.-D. (2024). Special Collection: Catalysts and Reactors under Dynamic Conditions for Energy Storage and Conversion. ChemCatChem, 16 (21), Art.-Nr.: 202401191. doi:10.1002/cctc.202401191
Neukum, D.; Ludwig, M. E.; Uzunidis, G.; Lakshmi Nilayam, A. R.; Krause, B.; Behrens, S.; Grunwaldt, J.-D.; Saraçi, E. (2024). Synergy of Ag and Pd in bimetallic catalysts for the selective oxidation of 5-(hydroxymethyl)furfural. Catalysis Science & Technology. doi:10.1039/D4CY01028K
Siegert, F.; Gundermann, M.; Maurer, L.; Hahn, S.; Hofmann, J.; Distel, M.; Schühle, J.; Müller, K.; Wolf, M.; Preuster, P.; Auer, F.; Geißelbrecht, M.; Wasserscheid, P. (2024). Autothermal hydrogen release from liquid organic hydrogen carrier systems. International Journal of Hydrogen Energy, 91, 834–842. doi:10.1016/j.ijhydene.2024.10.044
Rang, F.; Delrieux, T.; Maurer, F.; Flecken, F.; Grunwaldt, J.-D.; Hanf, S. (2024). Supported Binuclear Gold Phosphine Complexes as CO Oxidation Catalysts: Insights into the Formation of Surface‐Stabilized Au Particles. Small Science, 4 (12). doi:10.1002/smsc.202400345
Vadarlis, A. A.; Lacerda de Oliveira Campos, B.; Lemonidou, A. A.; Boukis, N.; Sauer, J. (2024). Supercritical Water Gasification of Ethanol as Biomass Model Compound in Tandem with Steam Reforming: Kinetic Modeling of the Reforming Step and Techno-Economic Analysis of the Integrated Concept. Industrial and Engineering Chemistry Research, 63 (39), 16683–16700. doi:10.1021/acs.iecr.4c01486
Hodonj, D.; Thiele, B.; Deutschmann, O.; Lott, P. (2024). Temperature-dependent frequency control of TWC operation for efficient CH
Bruder, J.; Fischer, K.; Armleder, J.; Müller, E.; Da Roit, N.; Behrens, S.; Peng, Y.; Wenzel, W.; Röhm, H.; Colsmann, A. (2024). Photocatalytic Hydrogen Generation in Surfactant‐Free, Aqueous Organic Nanoparticle Dispersions. Small, 20 (47), 2406236. doi:10.1002/smll.202406236
Vergara, T.; Gómez, D.; Warmuth, L.; Enß, A. E.; Peterlechner, M.; Pallacán, R.; Diaconescu, V. M.; Simonelli, L.; Studt, F.; Concepción, P.; Jiménez, R.; Karelovic, A. (2024). On the Structure Sensitivity of CO
Mockenhaupt, B.; Gieser, J.; Najafishirtari, S.; Baumgarten, L.; Jelic, J.; Lunkenbein, T.; Ras, E.-J.; Grunwaldt, J.-D.; Studt, F.; Behrens, M. (2024). On the secondary promotion effect of Al and Ga on Cu/ZnO methanol synthesis catalysts. Journal of Catalysis, 439, Art.-Nr.: 115785. doi:10.1016/j.jcat.2024.115785
Kuhn, C.; Kirn, M.; Tischer, S.; Deutschmann, O. (2024). Micron-sized iron particles as energy carrier: Cycling experiments in a fixed-bed reactor. Proceedings of the Combustion Institute, 40 (1-4), 105207. doi:10.1016/j.proci.2024.105207
Sen, K.; Schäfer, A.; Rosowski, F.; Sharapa, D. I.; Studt, F. (2024). Quantum Chemical Modeling of the Full Catalytic Cycle for Selective Oxidation of Propane to Propene on the M1 Phase of Mo–Te–Nb–O Mixed-Metal Oxide Catalysts. The Journal of Physical Chemistry C, 128 (34), 14273–14281. doi:10.1021/acs.jpcc.4c02899
Martins, T.; Sá, M. S. de; Silva, W. R.; Carriel Schmitt, C.; Moreira, R.; Raffelt, K.; Dahmen, N.; Wisniewski, A., Jr. (2024). Sugarcane biorefinery: Unlocking the potential of the pyrolytic process to convert waste biomasses into value-added products. Energy Conversion and Management, 318, 118913. doi:10.1016/j.enconman.2024.118913
Enss, A. E.; Huber, P.; Plessow, P. N.; Studt, F. (2024). Methanol-Mediated Hydrogen Transfer Reactions at Surface Lewis Acid Sites of H-SSZ-13. The Journal of Physical Chemistry C, 128 (37), 15367–15379. doi:10.1021/acs.jpcc.4c03408
Villagra-Soza, F.; Vergara, T.; Godoy, S.; Karelovic, A.; Jiménez, R. (2024). Unraveling the mechanistic interplay between CO and CO
Mokashi, M.; Shirsath, A. B.; Demir, S.; Çelik, A.; Lott, P.; Tischer, S.; Deutschmann, O. (2024). Kinetics of thermal dry reforming of methane for syngas production and solid carbon capture. Reaction Chemistry & Engineering, 9 (11), 2902–2914. doi:10.1039/d4re00312h
Paripsa, S.; Gaur, A.; Förste, F.; Doronkin, D. E.; Malzer, W.; Schlesiger, C.; Kanngießer, B.; Welter, E.; Grunwaldt, J.-D.; Lützenkirchen-Hecht, D. (2024). RefXAS: an open access database of X-ray absorption spectra. Journal of Synchrotron Radiation, 31 (5), 1105–1117. doi:10.1107/S1600577524006751
Das, S.; Kahnt, M.; van Valen, Y.; Bergh, T.; Blomberg, S.; Lyubomirskiy, M.; Schroer, C. G.; Venvik, H. J.; Sheppard, T. L. (2024). Restructuring of Ag catalysts for methanol to formaldehyde conversion studied using in situ X-ray ptychography and electron microscopy. Catalysis Science & Technology, 14 (20), 5885–5898. doi:10.1039/D4CY00770K
Chowdhury, A. G.; Arnold, U.; Garbev, K.; Bender, M.; Sauer, J. (2024). Direct dehydrogenation of methanol to formaldehyde over ZnO–SiO
Chowdhury, C. (2024). Bayesian Optimization for Efficient Prediction of Gas Uptake in Nanoporous Materials. ChemPhysChem, 25 (16), Art.-Nr.: e202300850. doi:10.1002/cphc.202300850
Guse, D.; Warmuth, L.; Herfet, M.; Adolf, K.; Zevaco, T. A.; Pitter, S.; Kind, M. (2024). Seeding as a Decisive Tool for Increasing Space-Time-Yields in the Preparation of High-Quality Cu/ZnO/ZrO₂ Catalysts. Catalysts, 14 (8), Article no: 517. doi:10.3390/catal14080517
Freund, H.; Sauer, J.; Ehrhardt, K. (2024). Die Fachsektion Chemische Reaktionstechnik von DECHEMA und VDI hat sich neu formiert. Chemie Ingenieur Technik, 96 (6), 719. doi:10.1002/cite.202400059
Shrestha, B.; Posom, J.; Sirisomboon, P.; Shrestha, B. P.; Funke, A. (2024). Effect of Combined Non-Wood and Wood Spectra of Biomass Chips on Rapid Prediction of Ultimate Analysis Parameters Using near Infrared Spectroscopy. Energies, 17 (2), Art.-Nr.: 439. doi:10.3390/en17020439
Shrestha, B.; Posom, J.; Sirisomboon, P.; Shrestha, B. P.; Pornchaloempong, P.; Funke, A. (2024). NIR Spectroscopy as an Alternative to Thermogravimetric Analyzer for Biomass Proximate Analysis: Comparison of Chip and Ground Biomass Models. Energies, 17 (4), Art.-Nr.: 800. doi:10.3390/en17040800
Fonseca, F. G.; Funke, A. (2024). Modeling of Liquid–Vapor Phase Equilibria of Pyrolysis Bio-oils: A Review. Industrial & Engineering Chemistry Research, 63 (31), 13401–13420. doi:10.1021/acs.iecr.4c00775
Mahayni, Y.; Maurer, L.; Auer, F.; Hutzler, A.; Wasserscheid, P.; Wolf, M. (2024). Structure sensitivity of the low temperature dehydrogenation of perhydro (di)benzyltoluene on supported platinum nanoparticles. Catalysis Science & Technology, 14 (18), 5464–5473. doi:10.1039/D4CY00032C
Weber, S.; Karpov, D.; Kahnt, M.; Diaz, A.; Romanenko, Y.; Kotrel, S.; Haas, A.; Hinrichsen, B.; Bottke, N.; Grunwaldt, J.-D.; Schunk, S.; Sheppard, T. L. (2024). Multimodal Hard X‐ray Nanotomography Probes Pore Accessibility of Technical Catalysts after Coking. ChemCatChem, 16 (22), e202301298. doi:10.1002/cctc.202301298
Parku, G. K.; Pulicanti, S. R.; Funke, A.; Dahmen, N. (2024). Phase Equilibria Aided Optimization of Levoglucosan Extraction during Condensation of Fast Pyrolysis Bio-Oils. Energy and Fuels, 38 (15), 14343–14350. doi:10.1021/acs.energyfuels.4c01097
Maurer, L. A.; Pham, C. v.; Fritsch, B.; Jeppesen, H. S.; Etter, M.; Hutzler, A.; Neder, R. B.; Wolf, M.; Auer, F.; Thiele, S.; Wasserscheid, P. (2024). Improving Hydrogen Release From Oxygen‐Functionalized LOHC Molecules by Ru Addition to Pt/C Catalysts. ChemCatChem, e202400375. doi:10.1002/cctc.202400375
Aschenbrenner, E.; Funke, A. (2024). Numerical Validation of a Screw Conveyor Design Method. Energy and Fuels, 38 (14), 13019 – 13028. doi:10.1021/acs.energyfuels.4c00189
Otroshchenko, T.; Sharapa, D. I.; Fedorova, E. A.; Zhao, D.; Kondratenko, E. V. (2024). Highly Efficient Low‐loaded PdOx/AlSiOx for Ethylene Dimerization. Angewandte Chemie International Edition, 63 (44), e202410646. doi:10.1002/anie.202410646
Hübner, J. L.; Lucchetti, L. E. B.; Nong, H. N.; Sharapa, D. I.; Paul, B.; Kroschel, M.; Kang, J.; Teschner, D.; Behrens, S.; Studt, F.; Knop-Gericke, A.; Siahrostami, S.; Strasser, P. (2024). Cation Effects on the Acidic Oxygen Reduction Reaction at Carbon Surfaces. ACS Energy Letters, 9 (4), 1331–1338. doi:10.1021/acsenergylett.3c02743
Borchers, M.; Förster, J.; Thrän, D.; Beck, S.; Thoni, T.; Korte, K.; Gawel, E.; Markus, T.; Schaller, R.; Rhoden, I.; Chi, Y.; Dahmen, N.; Dittmeyer, R.; Dolch, T.; Dold, C.; Herbst, M.; Heß, D.; Kalhori, A.; Koop-Jakobsen, K.; Li, Z.; Oschlies, A.; Reusch, T. B. H.; Sachs, T.; Schmidt-Hattenberger, C.; Stevenson, A.; Wu, J.; Yeates, C.; Mengis, N. (2024). A Comprehensive Assessment of Carbon Dioxide Removal Options for Germany. Earth’s Future, 12 (5), e2023EF003986. doi:10.1029/2023EF003986
Sarma, B. B.; Neukum, D.; Doronkin, D. E.; Lakshmi Nilayam, A. R.; Baumgarten, L.; Krause, B.; Grunwaldt, J.-D. (2024). Understanding the role of supported Rh atoms and clusters during hydroformylation and CO hydrogenation reactions with in situ / operando XAS and DRIFT spectroscopy. Chemical Science, 15 (31), 12369–12379. doi:10.1039/D4SC02907K
Braun, L.; Spielmann, J.; Doronkin, D. E.; Kuhn, C.; Maliugin, A.; Sharapa, D. I.; Huck, I.; Bao, J.; Tischer, S.; Studt, F.; Deutschmann, O.; Kramm, U. I.; Grunwaldt, J.-D. (2024). Following the Structural Changes of Iron Oxides during Reduction under Transient Conditions. ChemSusChem, 17 (24), Art.-Nr.: e202401045. doi:10.1002/cssc.202401045
Zengel, D.; Marchuk, V.; Kurt, M.; Maurer, F.; Salcedo, A.; Michel, C.; Loffreda, D.; Aouine, M.; Loridant, S.; Vernoux, P.; Störmer, H.; Casapu, M.; Grunwaldt, J.-D. (2024). Pd loading threshold for an efficient noble metal use in Pd/CeO2 methane oxidation catalysts. Applied Catalysis B: Environment and Energy, 358, Art.-Nr.: 124363. doi:10.1016/j.apcatb.2024.124363
Suarez Orduz, H. A.; Bugarin, L.; Heck, S.-L.; Dolcet, P.; Casapu, M.; Grunwaldt, J.-D.; Glatzel, P. (2024). L
Treu, P.; Gonçalves, D.; Lakshmi Nilayam, A. R.; Grunwaldt, J.-D.; Saraçi, E. (2024). One‐pot cascade reaction from epoxide to carboxylic acids using bifunctional Fe‐ZSM‐5. ChemCatChem, 16 (20), Art.-Nr.: 202400626. doi:10.1002/cctc.202400626
Eldridge, T. J.; Borchers, M.; Lott, P.; Grunwaldt, J.-D.; Doronkin, D. E. (2024). Elucidating the Role of the State of Pd in the H
Rex, A.; Almeida De Campos, L.; Gottschalk, T.; Ferreira Sanchez, D.; Trinke, P.; Czioska, S.; Saraçi, E.; Bensmann, B.; Grunwaldt, J.-D.; Hanke-Rauschenbach, R.; Sheppard, T. L. (2024). Elemental Distribution in Catalyst‐Coated Membranes of Proton Exchange Membrane Water Electrolysers Tracked by Synchrotron X‐Ray Fluorescence. Advanced Energy and Sustainability Research, 5 (9), Art.-Nr.: 2400048. doi:10.1002/aesr.202400048
Chen, S.; Pleßow, P. N.; Yu, Z.; Sauter, E.; Caulfield, L.; Nefedov, A.; Studt, F.; Wang, Y.; Wöll, C. (2024). Structure and Chemical Reactivity of Y‐Stabilized ZrO 2 Surfaces: Importance for the Water‐Gas Shift Reaction. Angewandte Chemie - International Edition, 63 (27), e202404775. doi:10.1002/anie.202404775
Dutzi, J.; Boukis, N.; Sauer, J. (2024). Investigating Salt Precipitation in Continuous Supercritical Water Gasification of Biomass. Processes, 12 (5), Art.-Nr.: 935. doi:10.3390/pr12050935
Delrieux, T.; Sharma, S.; Maurer, F.; Dolcet, P.; Lausch, M.; Zimina, A.; Cárdenas, C.; Lott, P.; Casapu, M.; Sheppard, T. L.; Grunwaldt, J.-D. (2024). A laboratory scale fast characterizing feedback loop for optimizing technical emission control catalysts. Reaction Chemistry & Engineering, 9 (11), 2868–2881. doi:10.1039/D4RE00168K
Parku, G. K.; Funke, A.; Dahmen, N. (2024). Influence of selected quench media used for direct contact condensation on yield and composition of fast pyrolysis bio-oils aided by thermodynamic phase equilibria modelling. Separation and Purification Technology, 341, Art.-Nr.: 126873. doi:10.1016/j.seppur.2024.126873
Sarma, B. B.; Grunwaldt, J.-D. (2024). Operando Spectroscopy to Understand Dynamic Structural Changes of Solid Catalysts. CHIMIA, 78 (5), 288–296. doi:10.2533/chimia.2024.288
Fan, Y.; Li, Q.; Fonseca, F. G.; Song, J.; Gong, M. (2024). Optimizing the Extraction of Sugars from Sewage Sludge Using Ultrasound Combined with Thermal–Alkali. Water (Switzerland), 16 (9), Art.-Nr.: 1289. doi:10.3390/w16091289
Fonseca, F. G.; Funke, A. (2024). Modeling Fast Pyrolysis of Waste Biomass: Improving Predictive Capability. Energy and Fuels, 38 (10), 8762–8776. doi:10.1021/acs.energyfuels.3c05233
Enss, A. E.; Plessow, P. N.; Studt, F. (2024). Theoretical investigation of the paring mechanism of the MTO process in different zeolites. Journal of Catalysis, 432, Art.-Nr.: 115363. doi:10.1016/j.jcat.2024.115363
Tusini, E.; Casapu, M.; Zimina, A.; Doronkin, D. E.; Störmer, H.; Barthe, L.; Belin, S.; Grunwaldt, J.-D. (2024). Structural Changes of Ni and Ni–Pt Methane Steam Reforming Catalysts During Activation, Reaction, and Deactivation Under Dynamic Reaction Conditions. ACS Catalysis, 7463–7477. doi:10.1021/acscatal.3c05847
Scotti, N.; Borsacchi, S.; Monti, S.; Zimina, A.; Evangelisti, C.; Geppi, M.; Dambruoso, P.; Barcaro, G.; Bossola, F.; Dal Santo, V.; Ravasio, N. (2024). Spectroscopic and theoretical investigation of Brønsted acid sites in amorphous mixed Zr-Si oxide nanoparticles. Journal of Alloys and Compounds, 992, Article no: 174545. doi:10.1016/j.jallcom.2024.174545
Spielmann, J.; Braig, D.; Streck, A.; Gustmann, T.; Kuhn, C.; Reinauer, F.; Kurnosov, A.; Leubner, O.; Potapkin, V.; Hasse, C.; Deutschmann, O.; Etzold, B. J. M.; Scholtissek, A.; Kramm, U. I. (2024). Exploring the oxidation behavior of undiluted and diluted iron particles for energy storage: Mössbauer spectroscopic analysis and kinetic modeling. Physical Chemistry Chemical Physics, 26 (17), 13049–13060. doi:10.1039/d3cp03484d
Neukum, D.; Lakshmi Nilayam, A. R.; Ludwig, M. E.; Vadarlis, A. A.; Grunwaldt, J.-D.; Saraçi, E. (2024). Correction: Continuous flow oxidation of HMF using a supported AuPd-alloy. Catalysis Science & Technology, 14 (8), Art.-Nr.: 2306. doi:10.1039/d4cy90028f
Schmitt, C.; Da Roit, N.; Neumaier, M.; Maliakkal, C. B.; Wang, D.; Henrich, T.; Kübel, C.; Kappes, M.; Behrens, S. (2024). Continuous flow synthesis of atom-precise platinum clusters. Nanoscale Advances. doi:10.1039/d4na00074a
Münzer, P.; Arnold, U.; Sauer, J. (2024). Process Design for the Directly Coupled Production of Methanol and Formaldehyde Based on CO
Reich, J.; Kaiser, S.; Heiz, U.; Grunwaldt, J.-D.; Kappes, M. M.; Esch, F.; Lechner, B. A. J. (2024). A Critical View on the Quantification of Model Catalyst Activity. Topics in Catalysis, 67 (13-14), 880–891. doi:10.1007/s11244-024-01920-0
Canabarro, N. I.; Yeadon, D. J.; Wörner, M.; Hornung, U.; Vogel, F.; Baudouin, D. (2024). Development of strategies for continuous desalination of weak black liquor based on phase-behaviour analysis. The Journal of Supercritical Fluids, 209, Art.-Nr.: 106230. doi:10.1016/j.supflu.2024.106230
Baehr, C.; Meyer Muñoz, T.; Raffelt, K.; Dahmen, N. (2024). Viscosity Reduction of Fast Pyrolysis Bio-Oil by Using CO
Das, S.; Stuckelberger, M. E.; Pottbacker, J.; Jakobtorweihen, S.; Schroer, C. G.; Horn, R.; Sheppard, T. L. (2024). Quantitative Chemical Mapping of Pt/Rh Gauze Catalysts for Ammonia Oxidation using Resonant X-ray Tomography. The Journal of Physical Chemistry C, 128 (12), 5053–5063. doi:10.1021/acs.jpcc.4c00041
Mokashi, M.; Shirsath, A. B.; Çelik, A.; Lott, P.; Müller, H.; Tischer, S.; Maier, L.; Bode, J.; Schlereth, D.; Scheiff, F.; Flick, D.; Bender, M.; Ehrhardt, K.; Deutschmann, O. (2024). Methane pyrolysis in packed bed reactors: Kinetic modeling, numerical simulations, and experimental insights. Chemical Engineering Journal, 485, Art.-Nr.: 149684. doi:10.1016/j.cej.2024.149684
Hagg, D.; Eifert, A.; Troßmann, T.; Frohnapfel, B.; Marschall, H.; Wörner, M. (2024). Numerical study of liquid imbibition and contact line pinning in a sealing gap for corrosion protection of metal housings. Progress in Computational Fluid Dynamics, An International Journal, 24 (2), 65 – 77. doi:10.1504/PCFD.2024.137058
Wörner, M.; Werner, L.; Hornung, U.; Islongo Canabarro, N.; Baudouin, D.; Dahmen, N. (2024). The Impact of Sulfur-Containing Inorganic Compounds during the Depolymerization of Lignin by Hydrothermal Liquefaction of Black Liquor. Energy & Fuels, 38 (7), 6036–6047. doi:10.1021/acs.energyfuels.3c04737
Wörner, M.; Barsuhn, A.; Zevaco, T.; Hornung, U.; Dahmen, N. (2024). From Pulp to Aromatic Products─Reaction Pathways of Lignin Depolymerization. Energy & Fuels, 38 (7), 6020–6035. doi:10.1021/acs.energyfuels.3c04509
Rosmini, C.; Pazos Urrea, M.; Tusini, E.; Indris, S.; Kovacheva, D.; Karashanova, D.; Kolev, H.; Zimina, A.; Grunwaldt, J.-D.; Rønning, M.; Dimitrov, M.; Popova, M. (2024). Unveiling the synergistic effects of pH and Sn content for tuning the catalytic performance of Ni^0/Ni_{x}Sn_{y} intermetallic compounds dispersed on Ce-Zr mixed oxides in the aqueous phase reforming of ethylene glycol. Applied catalysis / B, 350, Art.Nr.: 123904. doi:10.1016/j.apcatb.2024.123904
Pazos Urrea, M.; Meilinger, S.; Herold, F.; Gopakumar, J.; Tusini, E.; De Giacinto, A.; Zimina, A.; Grunwaldt, J.-D.; Chen, D.; Rønning, M. (2024). Aqueous Phase Reforming over Platinum Catalysts on Doped Carbon Supports: Exploring Platinum–Heteroatom Interactions. ACS Catalysis, 14 (6), 4139–4154. doi:10.1021/acscatal.3c05385
Neukum, D.; Saraçi, E.; Wüst, D.; Raj Lakshmi Nilayam, A.; Sharma, S.; Grunwaldt, J.-D. (2024). Rational process design for the efficient oxidation of crude HMF-solution using AuPd/C catalysts. Catalysis Today, 432, Article no: 114615. doi:10.1016/j.cattod.2024.114615
Zhang, Q.; Li, Y.; Otroshchenko, T.; Kondratenko, V. A.; Wu, K.; Fedorova, E. A.; Doronkin, D. E.; Bartling, S.; Lund, H.; Jiang, G.; Kondratenko, E. V. (2024). The enhancing effect of Co
Huang, J.; Klahn, M.; Tian, X.; Bartling, S.; Zimina, A.; Radtke, M.; Rockstroh, N.; Naliwajko, P.; Steinfeldt, N.; Peppel, T.; Grunwaldt, J.-D.; Logsdail, A. J.; Jiao, H.; Strunk, J. (2024). Fundamental structural and electronic understanding of palladium catalysts on nitride and oxide supports. Angewandte Chemie International Edition, Art.Nr.: e202400174. doi:10.1002/anie.202400174
Nazari, P.; Zimmermann, J.; Melzer, C.; Kowalsky, W.; Aghassi-Hagmann, J.; Hernandez-Sosa, G.; Lemmer, U. (2024). High‐Resolution Printed Ethylene Vinyl Acetate Based Strain Sensor for Impact Sensing. Advanced Sensor Research, 3 (7), Art.-Nr.: 2300189. doi:10.1002/adsr.202300189
Jalalinejad, A.; Yousefi Seyf, J.; Funke, A.; Dahmen, N. (2024). Phase Equilibrium Calculation of Bio-Oil-Related Molecules Using Predictive Thermodynamic Models. Energy and Fuels, 38 (4), 3171 – 3185. doi:10.1021/acs.energyfuels.3c04395
Smitshuysen, T. E. L.; Lützen, M.; Zimina, A.; Sheppard, T. L.; Jakobsen, H. H.; Chorkendorff, I.; Damsgaard, C. D. (2024). Using CoCu
Neukum, D.; Lakshmi Nilayam, A. R.; Ludwig, M. E.; Vadarlis, A. A.; Grunwaldt, J.-D.; Saraçi, E. (2024). Continuous flow oxidation of HMF using supported AuPd-alloy. Catalysis Science & Technology, 14 (8), 2130–2138. doi:10.1039/D3CY01722B
Rodrigues Niquini, G.; Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Pitter, S.; Sauer, J. (2024). Experimental study and comprehensive kinetic modeling of the direct dimethyl ether synthesis on Cu/ZnO/ZrO₂ and H-FER-20. Chemical Engineering Journal, 480, Art.-Nr.: 147968. doi:10.1016/j.cej.2023.147968
Nikolajsen, M. T.; Grivel, J.-C.; Gaur, A.; Hansen, L. P.; Baumgarten, L.; Schjødt, N. C.; Mentzel, U. V.; Grunwaldt, J.-D.; Sehested, J.; Christensen, J. M.; Høj, M. (2024). Surface ZnO
E-Moghaddam, M.; Dahmen, N.; Santo, U.; Sauer, J. (2024). Gasoline Synthesis from Biomass-Derived Syngas Comparing Different Methanol and Dimethyl Ether Pathways by Process Simulation, Based on the Bioliq Process. Energy & Fuels, 38 (5), 4229–4243. doi:10.1021/acs.energyfuels.3c04524
Prestigiacomo, C.; Fan, Y.; Hornung, U.; Dahmen, N.; Scialdone, O.; Galia, A. (2024). Hydrothermal liquefaction of sewage sludge: use of HCOOH and KOH to improve the slurry pumpability in a continuously operated plant. Heliyon, 10 (4), Art.-Nr.: e26287. doi:10.1016/j.heliyon.2024.e26287
Chawla, J.; Schardt, S.; Lott, P.; Angeli, S.; Tischer, S.; Maier, L.; Deutschmann, O. (2024). Detailed kinetic modeling of catalytic oxidative coupling of methane. Chemical Engineering Journal, 482, Art-Nr.: 148719. doi:10.1016/j.cej.2024.148719
Kesari, A. S.; Chaganti, S. K.; Chowdhury, C. (2024). Quantum simulation of small molecules for multiple applications. Chemical Physics, 580, Art.-Nr.: 112195. doi:10.1016/j.chemphys.2024.112195
Warmuth, L.; Steurer, M.; Schild, D.; Zimina, A.; Grunwaldt, J.-D.; Pitter, S. (2024). Reversible and Irreversible Structural Changes in Cu/ZnO/ZrO₂ Catalysts during Methanol Synthesis. ACS Applied Materials & Interfaces, 16 (7), 8813–8821. doi:10.1021/acsami.3c17383
Mehdipour, F.; Delrieux, T.; Maurer, F.; Grunwaldt, J.-D.; Klahn, C.; Dittmeyer, R. (2024). Opportunities and limitations of metal additive manufacturing of structured catalytic converters. Catalysis Communications, 187, 106873. doi:10.1016/j.catcom.2024.106873
Chacko, R.; Goßler, H.; Angeli, S.; Deutschmann, O. (2024). Interconnected Digital Solutions to Accelerate Modeling of the Reaction Kinetics in Catalysis. ChemCatChem, 16 (4), Art.-Nr.: e202301355. doi:10.1002/cctc.202301355
Zeh, A.; Zimmermann, M.; Albert, R.; Drüppel, K.; Gerdes, A. (2024). Zircon U-Pb-Hf isotope systematics of southern Black Forest gneiss units (Germany) – Implications for the pre-Variscan evolution of Central Europe. Gondwana Research, 128, 351–367. doi:10.1016/j.gr.2023.11.008
Neukum, D.; Saraci, E.; Krause, B.; Nilayam, A. R. L.; Sinigalia, A.; Grunwaldt, J.-D. (2024). Pushing the Efficiency of the Selective and Base‐free Air‐Oxidation of HMF by Varying the Properties of Carbon‐based Supports. ChemCatChem, 16 (10), e202301228. doi:10.1002/cctc.202301228
Klag, L.; Baumgarten, L.; Gaur, A.; Sheppard, T. L.; Grunwaldt, J.-D. (2024). Comparison of Structure and Reactivity of Hydrothermally Prepared Bi‐Mo‐Co‐Fe‐O Catalysts in Selective Propylene and Isobutene Oxidation. ChemCatChem, Art.-Nr.: e202301470. doi:10.1002/cctc.202301470
Lacerda de Oliveira Campos, B.; Oliveira Souza da Costa, A.; Herrera Delgado, K.; Pitter, S.; Sauer, J.; Ferreira da Costa Junior, E. (2024). Development of a surrogate artificial neural network for microkinetic modeling: case study with methanol synthesis. Reaction Chemistry & Engineering, 9 (5), 1047–1060. doi:10.1039/d3re00409k
Chen, S.; Jelic, J.; Rein, D.; Najafishirtari, S.; Schmidt, F.-P.; Girgsdies, F.; Kang, L.; Wandzilak, A.; Rabe, A.; Doronkin, D. E.; Wang, J.; Friedel Ortega, K.; DeBeer, S.; Grunwaldt, J.-D.; Schlögl, R.; Lunkenbein, T.; Studt, F.; Behrens, M. (2024). Highly loaded bimetallic iron-cobalt catalysts for hydrogen release from ammonia. Nature Communications, 15 (1), Art.-Nr.: 871. doi:10.1038/s41467-023-44661-6
Dutzi, J.; Boukis, N.; Sauer, J. (2024). Supercritical water gasification of heavy metal contaminated plants with focus on separation of heavy metal contaminants. Biomass and Bioenergy, 182, Article no: 107059. doi:10.1016/j.biombioe.2024.107059
Strauch, D.; Weiner, P.; Sarma, B. B.; Körner, A.; Herzinger, E.; Wolf, P.; Zimina, A.; Hutzler, A.; Doronkin, D. E.; Grunwaldt, J.-D.; Wasserscheid, P.; Wolf, M. (2024). Bimetallic platinum rhenium catalyst for efficient low temperature dehydrogenation of perhydro benzyltoluene. Catalysis Science & Technology, 14 (7), 1775–1790. doi:10.1039/D3CY01336G
Hodonj, D.; Borchers, M.; Zeh, L.; Hoang, G. T.; Tischer, S.; Lott, P.; Deutschmann, O. (2024). Impact of operation parameters and lambda input signal during lambda-dithering of three-way catalysts for low-temperature performance enhancement. Applied Catalysis B: Environmental, 345, Art.-Nr.: 123657. doi:10.1016/j.apcatb.2023.123657
Klag, L.; Weber, S.; Horn, R.; Sheppard, T. L.; Grunwaldt, J.-D. (2024). Exploring structure, temperature and activity correlations in the selective oxidation of lower olefins over Bi-Mo-Co-Fe-O catalysts by spatial reactor profile measurements. Catalysis Science & Technology, 14 (4), 863–877. doi:10.1039/D3CY01445B
Rodrigues Niquini, G.; Münzer, P.; Ebrahim-Moghaddam, M.; Warmuth, L.; Herrera Delgado, K.; Pitter, S.; Dahmen, N.; Sauer, J. (2024). Regenerativ erzeugter Wasserstoff – Perspektiven in chemischen Wertschöpfungsketten [Regeneratively Produced Hydrogen – Perspectives in Chemical Value Chains]. Chemie Ingenieur Technik, 96 (1-2), 100–113. doi:10.1002/cite.202300221
Suarez Orduz, H. A.; Heck, S.-L.; Dolcet, P.; Watier, Y.; Casapu, M.; Grunwaldt, J.-D.; Glatzel, P. (2024). Versatile spectroscopic cell for operando studies in heterogeneous catalysis using tender X‐ray spectroscopy in fluorescence mode. Chemistry–Methods. doi:10.1002/cmtd.202300044
Shekhar, S.; Chowdhury, C. (2024). Topological data analysis enhanced prediction of hydrogen storage in metal–organic frameworks (MOFs). Materials Advances, 2024 (5), 820–830. doi:10.1039/D3MA00591G
Weih, N.; Niebel, A.; Pfitzer, C.; Funke, A.; Parku, G. K.; Dahmen, N. (2024). Operational experience with miscanthus feedstock at the bioliq® fast pyrolysis plant. Journal of Analytical and Applied Pyrolysis, 177, Article no: 106338. doi:10.1016/j.jaap.2023.106338
Herzinger, E.; Wolf, M. (2024). Perspectives and Potential of Liquid Organic Hydrogen Carriers in the German Energy Scenario. Chemie Ingenieur Technik, 96 (1-2), 65–73. doi:10.1002/cite.202300227
Dutzi, J.; Stoll, I. K.; Boukis, N.; Sauer, J. (2024). Screening of ten different plants in the process of supercritical water gasification. Sustainable Chemistry for the Environment, 5, Art.-Nr.: 100062. doi:10.1016/j.scenv.2024.100062
Marchuk, V.; Sharapa, D. I.; Grunwaldt, J.-D.; Doronkin, D. E. (2024). Surface States Governing the Activity and Selectivity of Pt-Based Ammonia Slip Catalysts for Selective Ammonia Oxidation. ACS Catalysis, 14 (2), 1107–1120. doi:10.1021/acscatal.3c05019
Zimina, A.; Léon, A.; Steininger, R. (2024). Chemical bonding effects in Sc compounds studied using X-ray absorption and X-ray photoelectron spectroscopies. Physical Chemistry Chemical Physics, 26 (3), 2613–2621. doi:10.1039/D3CP04108E
Sheikh, K. A.; Zaghini Francesconi, V.; Zevaco, T. A.; Sauer, J. (2024). Carbonylation of dimethoxymethane: a study on the reactivity of different solid acid catalysts. Catalysis Science & Technology, 14, 1148–1166. doi:10.1039/D3CY01286G
Shekhar, S.; Chowdhury, C. (2024). Prediction of hydrogen storage in metal-organic frameworks: A neural network based approach. Results in Surfaces and Interfaces, 14, Art.-Nr.: 100166. doi:10.1016/j.rsurfi.2023.100166
Yang, M.; Yu, J.; Zimina, A.; Sarma, B. B.; Grunwaldt, J.-D.; Zada, H.; Wang, L.; Sun, J. (2024). Unlocking a Dual‐Channel Pathway in CO
Mokashi, M.; Bhimrao Shirsath, A.; Lott, P.; Müller, H.; Tischer, S.; Maier, L.; Deutschmann, O. (2024). Understanding of gas-phase methane pyrolysis towards hydrogen and solid carbon with detailed kinetic simulations and experiments. Chemical Engineering Journal, 479, Art.Nr.: 147556. doi:10.1016/j.cej.2023.147556
Perret, L.; Boukis, N.; Sauer, J. (2024). Synthesis gas fermentation at high cell density: How pH and hydrogen partial pressure affect productivity and product ratio in continuous fermentation. Bioresource Technology, 391 (Part A), Art.-Nr.: 129894. doi:10.1016/j.biortech.2023.129894
Zhao, D.; Kondratenko, V. A.; Doronkin, D. E.; Han, S.; Grunwaldt, J.-D.; Rodemerck, U.; Linke, D.; Kondratenko, E. V. (2024). Effect of supports on the kind of in-situ formed ZnOₓ species and its consequence for non-oxidative propane dehydrogenation. Catalysis Today, 428, 114444. doi:10.1016/j.cattod.2023.114444
Lott, P.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2024). A review on exhaust gas after-treatment of lean-burn natural gas engines – From fundamentals to application. Applied Catalysis B: Environmental, 340, Art.Nr.: 123241. doi:10.1016/j.apcatb.2023.123241
Vadarlis, A. A.; Neukum, D.; Lemonidou, A. A.; Boukis, N.; Sauer, J. (2024). Direct steam reforming of the product gas from ethanol gasification with supercritical water. International Journal of Hydrogen Energy, 49 (A), 992–1008. doi:10.1016/j.ijhydene.2023.08.108
Zimmermann, J.; Raffelt, K.; Dahmen, N. (2024). Suppressing the formation of N-heteroaromatics during hydrothermal liquefaction of proteinaceous model feedstock. Biomass Conversion and Biorefinery, 14 (19), 24671–24683. doi:10.1007/s13399-023-04553-7
Hinge, V. K.; Bairagi, M.; Yadav, N.; Joshi, S. K.; Shrivastava, B. D.; Jha, S. N.; Bhattacharya, D.; Gaur, A. (2024). Investigating local coordination and electronic nature of Cu centers in the copper complexes having aspartic and glutamic acids. X-Ray Spectrometry, 53 (1), 60–68. doi:10.1002/xrs.3369
2023
Book Chapters
Becher, J.; Sheppard, T.; Grunwaldt, J.-D. (2023). X-Ray Microscopy and Tomography. Springer Handbook of Advanced Catalyst Characterization. Ed.: I. Wachs, 689–738, Springer International Publishing. doi:10.1007/978-3-031-07125-6_32
Journal Articles
Spiske, L.; Plessow, P. N.; Kazmierczak, K.; Vandegehuchte, B. D.; Studt, F. (2023). Theoretical investigation of catalytic n-butane isomerization over H-SSZ-13. Frontiers in Catalysis, 3, Art.-Nr.: 1213803. doi:10.3389/fctls.2023.1213803
Delove Tegladza, I.; Kordorwu, V.; Kofi Parku, G.; Bentum Hammond, C.; Hammond Quarcoo, F. (2023). Modelling studies of the diffusivity and intersolubility of semi volatile organic compounds in water. The holistic approach to environment, 13 (2), 63–75. doi:10.33765/thate.13.2.3
Ajikashile, J. O.; Alhnidi, M.-J.; Parku, G. K.; Funke, A.; Kruse, A. (2023). A study on the fast pyrolysis of millet and sorghum straws sourced from arid and semi-arid regions of Nigeria in a twin-screw mixing reactor. Materials Science for Energy Technologies, 6, 388–398. doi:10.1016/j.mset.2023.03.007
Dolcet, P.; Grunwaldt, J.-D.; Hövelmann, S.; Amelung, L.; Schneidewind, A. (2023). DAta from PHoton and Neutron Experiments – DAPHNE4NFDI – Annual Meeting 2023. Synchrotron Radiation News, 36 (6), 55–57. doi:10.1080/08940886.2023.2277655
Scholz, B.; Oshchepkov, A. S.; Papaianina, O.; Ruppenstein, C.; Akhmetov, V. A.; Sharapa, D. I.; Amsharov, K. Y.; Pérez-Ojeda, M. E. (2023). An Indacenopicene‐based Buckybowl Catcher for Recognition of Fullerenes. Chemistry – A European Journal, 29 (70), Art.-Nr.: e202303814. doi:10.1002/chem.202303814
Vergara, T.; Gómez, D.; Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Jiménez, R.; Karelovic, A. (2023). Disclosing the Reaction Mechanism of CO 2 Hydrogenation to Methanol over CuCeO x /TiO 2 : A Combined Kinetic, Spectroscopic, and Isotopic Study. ACS Catalysis, 13 (22), 14699–14715. doi:10.1021/acscatal.3c04243
Wan, S.; Häber, T.; Lott, P.; Suntz, R.; Deutschmann, O. (2023). Experimental investigation of NO reduction by H2 on Pd using planar laser-induced fluorescence. Applications in Energy and Combustion Science, 16, Art.-Nr.: 100229. doi:10.1016/j.jaecs.2023.100229
Phan Dang, C.-T.; Tam, N. M.; Huynh, T.-N.; Trung, N. T. (2023). Revisiting conventional noncovalent interactions towards a complete understanding: from tetrel to pnicogen, chalcogen, and halogen bond. RSC Advances, 13 (45), 31507–31517. doi:10.1039/d3ra06078k
Huber, P.; Pleßow, P. N. (2023). The role of decarboxylation reactions during the initiation of the methanol-to-olefins process. Journal of Catalysis, 428, Art.-Nr.: 115134. doi:10.1016/j.jcat.2023.115134
Scholz, B.; Oshchepkov, A. S.; Papaianina, O.; Ruppenstein, C.; Akhmetov, V. A.; Sharapa, D. I.; Amsharov, K. Y.; Pérez-Ojeda, M. E. (2023). An Indacenopicene‐based Buckybowl Catcher for Recognition of Fullerenes. Chemistry – A European Journal, 29 (70), Art.-Nr.: e202302778. doi:10.1002/chem.202302778
Ramanathan, E. S.; Chowdhury, C. (2023). Structural and Electronic Properties of Two‐Dimensional Materials: A Machine‐Learning‐Guided Prediction. ChemPhysChem, 24 (21), e202300308. doi:10.1002/cphc.202300308
Ghude, S.; Chowdhury, C. (2023). Exploring Hydrogen Storage Capacity in Metal‐Organic Frameworks: A Bayesian Optimization Approach. Chemistry – A European Journal, 29 (69), e202301840. doi:10.1002/chem.202301840
Semmel, M.; Kerschbaum, M.; Steinbach, B.; Sauer, J.; Salem, O. (2023). Optimized design and techno-economic analysis of novel DME production processes. Reaction Chemistry & Engineering, 8 (11), 2826–2840. doi:10.1039/d3re00333g
Eichner, F.; Sauer, J.; Bender, M.; Behrens, S. (2023). The titania-catalyzed oxidative dehydrogenation of methanol to formaldehyde. Applied Catalysis A: General, 663, Art.-Nr.: 119305. doi:10.1016/j.apcata.2023.119305
Baehr, C.; Acar, R.; Hamrita, C.; Raffelt, K.; Dahmen, N. (2023). CO
Campos Fraga, M. M.; Vogt, J.; Lacerda de Oliveira Campos, B.; Schmitt, C. C.; Raffelt, K.; Dahmen, N. (2023). Investigation of Nb
Klag, L.; Gaur, A.; Stehle, M.; Weber, S.; Sheppard, T. L.; Grunwaldt, J.-D. (2023). Role of Iron and Cobalt in 4-Component Bi–Mo–Co–Fe–O Catalysts for Selective Isobutene Oxidation Using Complementary Operando Techniques. ACS Catalysis, 13, 14241–14256. doi:10.1021/acscatal.3c03433
Mazzariol, C.; Tajoli, F.; Sedykh, A. E.; Dolcet, P.; Grunwaldt, J.-D.; Müller-Buschbaum, K.; Gross, S. (2023). Effective Space Confinement by Inverse Miniemulsion for the Controlled Synthesis of Undoped and Eu
Dutzi, J.; Boukis, N.; Sauer, J. (2023). Energetic Assessment of SCWG Experiments with Reed Canary Grass and Ethanol Solution on Laboratory and Pilot Scale. Energies, 16 (19), Article no: 6848. doi:10.3390/en16196848
Vergara, T.; Gómez, D.; Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Concepción, P.; Jiménez, R.; Karelovic, A. (2023). Combined role of Ce promotion and TiO2 support improves CO2 hydrogenation to methanol on Cu catalysts: Interplay between structure and kinetics. Journal of Catalysis, 426, 200–213. doi:10.1016/j.jcat.2023.07.017
Pola, L.; Collado, S.; Wörner, M.; Hornung, U.; Díaz, M. (2023). Eutectic solvents for the valorisation of the aqueous phase from hydrothermally liquefied black liquor. Journal of Environmental Chemical Engineering, 11 (5), Art.-Nr.: 111040. doi:10.1016/j.jece.2023.111040
Huang, X.; Eggart, D.; Qin, G.; Sarma, B. B.; Gaur, A.; Yang, J.; Pan, Y.; Li, M.; Hao, J.; Yu, H.; Zimina, A.; Guo, X.; Xiao, J.; Grunwaldt, J.-D.; Pan, X.; Bao, X. (2023). Methyl radical chemistry in non-oxidative methane activation over metal single sites. Nature Communications, 14, Article no: 5716. doi:10.1038/s41467-023-41192-y
Sarma, B. B.; Jelic, J.; Neukum, D.; Doronkin, D. E.; Huang, X.; Bernart, S.; Studt, F.; Grunwaldt, J.-D. (2023). Correction to “Tracking and Understanding Dynamics of Atoms and Clusters of Late Transition Metals with In-Situ DRIFT and XAS Spectroscopy Assisted by DFT”. The Journal of Physical Chemistry C, 127 (23), Art.-Nr.: 11419. doi:10.1021/acs.jpcc.3c03075
Pola, L.; Collado, S.; Wörner, M.; Hornung, U.; Díaz, M. (2023). Valorisation of the residual aqueous phase from hydrothermally liquefied black liquor by persulphate-based advanced oxidation. Chemosphere, 339, Art.-Nr.: 139737. doi:10.1016/j.chemosphere.2023.139737
Kreitz, B.; Lott, P.; Studt, F.; Medford, A. J. J.; Deutschmann, O.; Goldsmith, C. F. (2023). Automated Generation of Microkinetics for Heterogeneously Catalyzed Reactions Considering Correlated Uncertainties. Angewandte Chemie - International Edition, 62 (39), Art.-Nr.: e202306514. doi:10.1002/anie.202306514
Perret, L.; Boukis, N.; Sauer, J. (2023). Influence of Increased Cell Densities on Product Ratio and Productivity in Syngas Fermentation. Industrial & Engineering Chemistry Research, 62 (35), 13799–13810. doi:10.1021/acs.iecr.3c01911
Vajglova, Z.; Yevdokimova, O.; Medina, A.; Eränen, K.; Tirri, T.; Hemming, J.; Linden, J.; Angervo, I.; Damlin, P.; Doronkin, D. E.; Mäki-Arvela, P.; Murzin, D. (2023). Solventless hydrodeoxygenation of isoeugenol and dihydroeugenol in the batch and continuous modes over zeolite-supported FeNi catalyst. Sustainable Energy & Fuels, 7, 4486–4504. doi:10.1039/D3SE00371J
Dutzi, J.; Vadarlis, A. A.; Boukis, N.; Sauer, J. (2023). Comparison of Experimental Results with Thermodynamic Equilibrium Simulations of Supercritical Water Gasification of Concentrated Ethanol Solutions with Focus on Water Splitting. Industrial & Engineering Chemistry Research, 62 (32), 12501–12512. doi:10.1021/acs.iecr.3c01595
Sheikh, K. A.; Zevaco, T. A.; Jelic, J.; Studt, F.; Bender, M. (2023). Efficient noble metal promoted bimetallic cobalt catalysts in the selective synthesis of acetaldehyde dimethyl acetal. RSC Advances, 13 (33), 22698–22709. doi:10.1039/D3RA02784H
Vadarlis, A. A.; Angeli, S. D.; Lemonidou, A. A.; Boukis, N.; Sauer, J. (2023). Catalytic Biomass Gasification in Supercritical Water and Product Gas Upgrading. ChemBioEng Reviews, 10 (4), 370–398. doi:10.1002/cben.202300007
Chang, X.; Zhao, Z.-J.; Lu, Z.; Chen, S.; Luo, R.; Zha, S.; Li, L.; Sun, G.; Pei, C.; Gong, J. (2023). Designing single-site alloy catalysts using a degree-of-isolation descriptor. Nature Nanotechnology, 18 (6), 611–616. doi:10.1038/s41565-023-01344-z
Wang, Y.; Qin, S.; Denisov, N.; Kim, H.; Bad’ura, Z.; Sarma, B. B.; Schmuki, P. (2023). Reactive Deposition Versus Strong Electrostatic Adsorption (SEA): A Key to Highly Active Single Atom Co‐Catalysts in Photocatalytic H
Kant, P.; Liang, S.; Rubin, M.; Ozin, G. A.; Dittmeyer, R. (2023). Low-cost photoreactors for highly photon/energy-efficient solar-driven synthesis. Joule, 7 (6), 1347 – 1362. doi:10.1016/j.joule.2023.05.006
Freund, H.; Sauer, J.; Wachsen, O. (2023). „Digitalisierung der Reaktionstechnik“: ein Themenfeld mit vielen Facetten!. Chemie Ingenieur Technik, 95 (5), 619. doi:10.1002/cite.202370502
Zimmermann, R. T.; Weber, S.; Bremer, J.; Idakiev, V.; Pashminehazar, R.; Sheppard, T. L.; Mörl, L.; Sundmacher, K. (2023). Core–shell catalyst pellets for effective reaction heat management. Chemical Engineering Journal, 457, Art.-Nr.: 140921. doi:10.1016/j.cej.2022.140921
Kalinin, M. A.; Kriebel, M.; Oshchepkov, A. S.; Sharapa, D. I. (2023). Graphocrown—A Novel, Two-Dimensional Oxocarbon: A Theoretical Study. Crystals, 13 (6), Art.-Nr.: 909. doi:10.3390/cryst13060909
Amsler, J.; Plessow, P. N.; Studt, F.; Bučko, T. (2023). Anharmonic Correction to Free Energy Barriers from DFT-Based Molecular Dynamics Using Constrained Thermodynamic Integration. Journal of Chemical Theory and Computation, 19 (9), 2455–2468. doi:10.1021/acs.jctc.3c00169
Fuchs, C.; Arnold, U.; Sauer, J. (2023). (Co‐)Oligomerization of Olefins to Hydrocarbon Fuels: Influence of Feed Composition and Pressure. Chemie Ingenieur Technik, 95 (5), 651–657. doi:10.1002/cite.202200209
Huber, P.; Plessow, P. N. (2023). A computational investigation of the decomposition of acetic acid in H-SSZ-13 and its role in the initiation of the MTO process. Catalysis Science & Technology, 13 (6), 1905–1917. doi:10.1039/d2cy01779b
Semmel, M.; Bogatykh, I.; Steinbach, B.; Sauer, J.; Repke, J.-U.; Salem, O. (2023). Demonstration and experimental model validation of the DME synthesis by reactive distillation in a pilot-scale pressure column. Reaction Chemistry & Engineering, 8, 2309–2322. doi:10.1039/d3re00200d
Jalalinejad, A.; Seyf, J. Y.; Funke, A.; Dahmen, N. (2023). Solvent Screening for Separation of Lignin-Derived Molecules Using the NIST-UNIFAC Model. ACS Sustainable Chemistry and Engineering, 11 (20), 7863–7873. doi:10.1021/acssuschemeng.3c00906
Vajglová, Z.; Gauli, B.; Mäki-Arvela, P.; Kumar, N.; Eränen, K.; Wärnå, J.; Lassfolk, R.; Simakova, I. L.; Prosvirin, I. P.; Peurla, M.; Lindén, J. K. M.; Huhtinen, H.; Paturi, P.; Doronkin, D. E.; Murzin, D. Y. (2023). Interactions between Iron and Nickel in Fe–Ni Nanoparticles on Y Zeolite for Co-Processing of Fossil Feedstock with Lignin-Derived Isoeugenol. ACS Applied Nano Materials, 6 (12), 10064–10077. doi:10.1021/acsanm.3c00620
Esmaeilpour, M.; Bügel, P.; Fink, K.; Studt, F.; Wenzel, W.; Kozlowska, M. (2023). Multiscale Model of CVD Growth of Graphene on Cu(111) Surface. International Journal of Molecular Sciences, 24 (10), Art.-Nr.: 8563. doi:10.3390/ijms24108563
Wörner, M. (2023). Maximum spreading of an impacting drop. International Journal of Multiphase Flow, 167, Artkl.Nr.: 104528. doi:10.1016/j.ijmultiphaseflow.2023.104528
Bhimrao Shirsath, A.; Schulte, M. L.; Kreitz, B.; Tischer, S.; Grunwaldt, J.-D.; Deutschmann, O. (2023). Spatially-resolved investigation of CO2 methanation over Ni/γ-Al2O3 and Ni3.2Fe/γ-Al2O3 catalysts in a packed-bed reactor. Chemical Engineering Journal, Art.-Nr.: 143847. doi:10.1016/j.cej.2023.143847
Keller, K.; Lott, P.; Tischer, S.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2023). Methane Oxidation over PdO: Towards a Better Understanding of the Influence of the Support Material. ChemCatChem, 15 (11), Art.-Nr.: e202300366. doi:10.1002/cctc.202300366
Wollak, B.; Espinoza, D.; Dippel, A.-C.; Sturm, M.; Vrljic, F.; Gutowski, O.; Nielsen, I. G.; Sheppard, T. L.; Korup, O.; Horn, R. (2023). Catalytic reactor for operando spatially resolved structure–activity profiling using high-energy X-ray diffraction. Journal of Synchrotron Radiation, 30 (Pt 3), 571–581. doi:10.1107/S1600577523001613
Chacko, R.; Keller, K.; Tischer, S.; Shirsath, A. B.; Lott, P.; Angeli, S.; Deutschmann, O. (2023). Automating the Optimization of Catalytic Reaction Mechanism Parameters Using Basin-Hopping: A Proof of Concept. The Journal of Physical Chemistry C, 127 (16), 7628–7639. doi:10.1021/acs.jpcc.2c08179
Potter, M. E.; Amsler, J.; Spiske, L.; Plessow, P. N.; Asare, T.; Carravetta, M.; Raja, R.; Cox, P. A.; Studt, F.; Armstrong, L.-M. (2023). Combining Theoretical and Experimental Methods to Probe Confinement within Microporous Solid Acid Catalysts for Alcohol Dehydration. ACS Catalysis, 13 (9), 5955–5968. doi:10.1021/acscatal.3c00352
Nazari, P.; Bäuerle, R.; Bäuerle, R.; Zimmermann, J.; Melzer, C.; Schwab, C.; Smith, A.; Kowalsky, W.; Aghassi-Hagmann, J.; Hernandez-Sosa, G.; Lemmer, U. (2023). Piezoresistive Free‐standing Microfiber Strain Sensor for High‐resolution Battery Thickness Monitoring. Advanced Materials, 35 (21), Art.-Nr.: 2212189. doi:10.1002/adma.202212189
Engl, T.; Langer, M.; Freund, H.; Rubin, M.; Dittmeyer, R. (2023). Tap Reactor for Temporally and Spatially Resolved Analysis of the CO
Eichner, F.; Turan, E.; Sauer, J.; Bender, M.; Behrens, S. (2023). Supported silver and copper catalysts in the oxidative dehydrogenation of methanol to formaldehyde: a comparative study under industrially relevant conditions. Catalysis Science & Technology, 13, 2349–2359. doi:10.1039/D2CY01405J
Hakimioun, A. H.; Vandegehuchte, B. D.; Curulla-Ferre, D.; Kaźmierczak, K.; Plessow, P. N.; Studt, F. (2023). Metal–Support Interactions in Heterogeneous Catalysis: DFT Calculations on the Interaction of Copper Nanoparticles with Magnesium Oxide. ACS Omega, 8 (11), 10591–10599. doi:10.1021/acsomega.3c00502
Vajglová, Z.; Gauli, B.; Mäki-Arvela, P.; Simakova, I. L.; Kumar, N.; Eränen, K.; Tirri, T.; Lassfolk, R.; Peurla, M.; Doronkin, D. E.; Murzin, D. Y. (2023). Co-processing of fossil feedstock with lignin-derived model compound isoeugenol over Fe-Ni/H-Y-5.1 catalysts. Journal of Catalysis, 421, 101–116. doi:10.1016/j.jcat.2023.03.016
Marchuk, V.; Huang, X.; Grunwaldt, J.-D.; Doronkin, D. E. (2023). Structure sensitivity of alumina- and zeolite-supported platinum ammonia slip catalysts. Catalysis Science & Technology. doi:10.1039/D2CY02095E
Shirsath, A. B.; Mokashi, M.; Lott, P.; Müller, H.; Pashminehazar, R.; Sheppard, T.; Tischer, S.; Maier, L.; Grunwaldt, J.-D.; Deutschmann, O. (2023). Soot Formation in Methane Pyrolysis Reactor: Modeling Soot Growth and Particle Characterization. The Journal of Physical Chemistry A, 127 (9), 2136–2147. doi:10.1021/acs.jpca.2c06878
Dutzi, J.; Boukis, N.; Sauer, J. (2023). Process Effluent Recycling in the Supercritical Water Gasification of Dry Biomass. Processes, 11 (3), Art.-Nr.: 797. doi:10.3390/pr11030797
Machoke, A. G. F.; Arias, A. M.; Baracchini, G.; Rubin, M.; Baser, H.; Weissenberger, T.; Dittmeyer, R.; Weber, A.; Hartmann, M.; Schwieger, W. (2023). MFI Type Zeolite Aggregates with Nanosized Particles via a Combination of Spray Drying and Steam-Assisted Crystallization (SAC) Techniques. Catalysts, 13 (3), Art.-Nr.: 536. doi:10.3390/catal13030536
Sheikh, K. A.; Drexler, R.; Zevaco, T. A.; Sauer, J.; Bender, M. (2023). Hydrogenation of Carbon Monoxide in the Liquid Phase: Influence of the Synthetic Methods on Characteristics and Activity of Hydrogenation Catalysts. Catalysts, 13 (3), 482. doi:10.3390/catal13030482
Mockenhaupt, B.; Schwiderowski, P.; Jelic, J.; Studt, F.; Muhler, M.; Behrens, M. (2023). High-Pressure Pulsing of Ammonia Results in Carbamate as Strongly Inhibiting Adsorbate of Methanol Synthesis over Cu/ZnO/Al
Zhao, D.; Gao, M.; Tian, X.; Doronkin, D. E.; Han, S.; Grunwaldt, J.-D.; Rodemerck, U.; Linke, D.; Ye, M.; Jiang, G.; Jiao, H.; Kondratenko, E. V. (2023). Effect of Diffusion Constraints and ZnOx Speciation on Nonoxidative Dehydrogenation of Propane and Isobutane over ZnO-Containing Catalysts. ACS Catalysis, 13, 3356–3369. doi:10.1021/acscatal.2c05704
Zakgeym, D.; Hofmann, J. D.; Maurer, L. A.; Auer, F.; Müller, K.; Wolf, M.; Wasserscheid, P. (2023). Better through oxygen functionality? The benzophenone/dicyclohexylmethanol LOHC-system. Sustainable Energy & Fuels, 7, 1213–1222. doi:10.1039/D2SE01750D
Parku, G. K.; Krutof, A.; Funke, A.; Richter, D.; Dahmen, N. (2023). Using Fractional Condensation to Optimize Aqueous Pyrolysis Condensates for Downstream Microbial Conversion. Industrial and Engineering Chemistry Research, 62 (6), 2792–2803. doi:10.1021/acs.iecr.2c03598
Kordus, D.; Jelic, J.; Lopez Luna, M.; Divins, N. J.; Timoshenko, J.; Timoshenko, J.; Chee, S. W.; Rettenmaier, C.; Kröhnert, J.; Kühl, S.; Trunschke, A.; Trunschke, A.; Schlögl, R.; Studt, F.; Roldan Cuenya, B. (2023). Shape-Dependent CO
Borgmann, L. M.; Johnsen, S.; Oliveira, C., Santos de; Martins de Souza e Silva, J.; Li, J.; Kirchlechner, C.; Gomard, G.; Wiegand, G.; Hölscher, H. (2023). Porous polymeric microparticles foamed with supercritical CO₂ as scattering white pigments. Bioinspiration & Biomimetics, 18 (2), Art.-Nr. 026011. doi:10.1088/1748-3190/acb899
Niethammer, B.; Arnold, U.; Sauer, J. (2023). Suppressing the aromatic cycle of the dimethyl ether to hydrocarbons reaction on zeolites. Applied Catalysis A: General, 651, Art.-Nr.: 119021. doi:10.1016/j.apcata.2023.119021
Sarma, B. B.; Jelic, J.; Neukum, D.; Doronkin, D. E.; Huang, X.; Studt, F.; Grunwaldt, J.-D. (2023). Tracking and Understanding Dynamics of Atoms and Clusters of Late Transition Metals with In-Situ DRIFT and XAS Spectroscopy Assisted by DFT. The Journal of Physical Chemistry C, 127 (6), 3032–3046. doi:10.1021/acs.jpcc.2c07263
Michler, T.; Wippermann, N.; Toedter, O.; Niethammer, B.; Otto, T.; Arnold, U.; Pitter, S.; Koch, T.; Sauer, J. (2023). Corrigendum to “Gasoline from the bioliq® process: Production, characterization and performance” [Fuel Processing Technology 206 (2020) 106476]. Fuel Processing Technology, 240, Art.Nr. 107577. doi:10.1016/j.fuproc.2022.107577
Plessow, P. N.; Studt, F. (2023). Cooperative Effects of Active Sites in the MTO Process: A Computational Study of the Aromatic Cycle in H-SSZ-13. ACS Catalysis, 13 (1), 624–632. doi:10.1021/acscatal.2c04694
Evers, J.; Klapötke, T. M.; Beck, W.; Völkl, M. B. R.; Oehlinger, G.; Köppe, R.; Zimina, A.; Wolf, S. (2023). PdCl(NO) – an iconic compound with corrugated Pd
Klag, L.; Sheppard, T. L.; Grunwaldt, J.-D. (2023). An Advanced Characterization Toolbox for Selective Olefin Oxidation Catalysts. ChemCatChem, 15 (3), Art.-Nr.: e202201276. doi:10.1002/cctc.202201276
Bodziony, F.; Wörner, M.; Marschall, H. (2023). The stressful way of droplets along single fibre strands : A computational analysis. Physics of Fluids, 35 (1), Art.-Nr.: 012110. doi:10.1063/5.0131032
Wu, S.-M.; Hwang, I.; Osuagwu, B.; Will, J.; Wu, Z.; Sarma, B. B.; Pu, F.-F.; Wang, L.-Y.; Badura, Z.; Zoppellaro, G.; Spiecker, E.; Schmuki, P. (2023). Fluorine Aided Stabilization of Pt Single Atoms on TiO
Fan, Y.; Meyer, L.; Gong, M.; Krause, B.; Hornung, U.; Dahmen, N. (2023). Understanding the fate of nitrogen during catalytic hydrothermal liquefaction of sewage sludge. Fuel, 339, Art.-Nr.: 126948. doi:10.1016/j.fuel.2022.126948
Sarma, B. B.; Maurer, F.; Doronkin, D. E.; Grunwaldt, J.-D. (2023). Design of Single-Atom Catalysts and Tracking Their Fate Using Operando and Advanced X-ray Spectroscopic Tools. Chemical Reviews, 123 (1), 379–444. doi:10.1021/acs.chemrev.2c00495
Zhang, R.; Cao, Y.; Doronkin, D. E.; Ma, M.; Dong, F.; Zhou, Y. (2023). Single-atom dispersed Zn-N3 active sites bridging the interlayer of g-C3N4 to tune NO oxidation pathway for the inhibition of toxic by-product generation. Chemical Engineering Journal, 454 (Part 1), Art.-Nr.: 140084. doi:10.1016/j.cej.2022.140084
Kant, P.; Trinkies, L. L.; Gensior, N.; Fischer, D.; Rubin, M.; Alan Ozin, G.; Dittmeyer, R. (2023). Isophotonic reactor for the precise determination of quantum yields in gas, liquid, and multi-phase photoreactions. Chemical Engineering Journal, 452 (Part 2), Art.-Nr.: 139204. doi:10.1016/j.cej.2022.139204
Jung, D.; Duman, G.; Zimmermann, M.; Kruse, A.; Yanik, J. (2023). Hydrothermal carbonization of fructose—effect of salts and reactor stirring on the growth and formation of carbon spheres. Biomass Conversion and Biorefinery, 13, 6281–6297. doi:10.1007/s13399-021-01782-6
Arnold, U.; Ghosh Chowdhury, A.; Drexler, M.; Eichner, F.; Zaghini Francesconi, V.; Fuchs, C.; Münzer, P.; Niethammer, B.; Sheikh, K.; Sauer, J. (2023). Methanol als Schlüsselelement für die Herstellung von Kraftstoffen Teil 2. gwf Gas + Energie, 164 (02-03), 58–67.
Arnold, U.; Ghosh Chowdhury, A.; Drexler, M.; Eichner, F.; Zaghini Francesconi, V.; Fuchs, C.; Münzer, P.; Niethammer, B.; Sheikh, K.; Sauer, J. (2023). Methanol als Schlüsselelement für die Herstellung von Kraftstoffen Teil 1. gwf Gas + Energie, 164 (01), 71–77.
2022
Journal Articles
Behrendt, G.; Prinz, N.; Wolf, A.; Baumgarten, L.; Gaur, A.; Grunwaldt, J.-D.; Zobel, M.; Behrens, M.; Mangelsen, S. (2022). Substitution of Copper by Magnesium in Malachite: Insights into the Synthesis and Structural Effects. Inorganic Chemistry, 61 (49), 19678–19694. doi:10.1021/acs.inorgchem.2c01976
Rüde, T.; Lu, Y.; Anschütz, L.; Blasius, M.; Wolf, M.; Preuster, P.; Wasserscheid, P.; Geißelbrecht, M. (2022). Performance of Continuous Hydrogen Production from Perhydro Benzyltoluene by Catalytic Distillation and Heat Integration Concepts with a Fuel Cell. Energy Technology, 11 (3), Art.-Nr.: 2201366. doi:10.1002/ente.202201366
Zha, S.; Sharapa, D. I.; Liu, S.; Zhao, Z.-J.; Studt, F. (2022). Modeling CoCu Nanoparticles Using Neural Network-Accelerated Monte Carlo Simulations. The Journal of Physical Chemistry A, 126 (50), 9440–9446. doi:10.1021/acs.jpca.2c07888
Fuchs, C.; Arnold, U.; Sauer, J. (2022). Effect of nickel loading on fuel production via heterogeneously catalyzed oligomerization of methanol‐based olefins. Chemie Ingenieur Technik, 94 (9), 1215–1215. doi:10.1002/cite.202255176
Virt, M.; Arnold, U. (2022). Effects of Oxymethylene Ether in a Commercial Diesel Engine. Cognitive Sustainability, 1 (3). doi:10.55343/cogsust.20
Carriel Schmitt, C.; Rapp, M.; Voigt, A.; De Carvalho, M. dos S. (2022). Selective Detection of Aromatic Compounds with a Re-Designed Surface Acoustic Wave Sensor System Using a Short Packed Column. Coatings, 12 (11), Art.-Nr.: 1666. doi:10.3390/coatings12111666
Semmel, M.; Steiner, L.; Bontrup, M.; Sauer, J.; Salem, O. (2022). Catalyst screening and reaction kinetics of liquid phase DME synthesis under reactive distillation conditions. Chemical Engineering Journal, 455, Art.Nr. 140525. doi:10.1016/j.cej.2022.140525
Freund, H.; Sauer, J.; Wachsen, O. (2022). Wie verändert sich die Reaktions‐ und Reaktortechnik durch die Elektrifizierung chemischer Prozesse?. Chemie Ingenieur Technik, 94 (5), 615. doi:10.1002/cite.202270502
Yang, M.; Yu, J.; Zimina, A.; Sarma, B. B.; Pandit, L.; Grunwaldt, J.-D.; Zhang, L.; Xu, H.; Sun, J. (2022). Probing the Nature of Zinc in Copper‐Zinc‐Zirconium Catalysts by Operando Spectroscopies for CO2 Hydrogenation to Methanol. Angewandte Chemie International Edition, 62 (7), Art.Nr. e202216803. doi:10.1002/anie.202216803
Borchers, M.; Lott, P.; Deutschmann, O. (2022). Selective Catalytic Reduction with Hydrogen for Exhaust gas after-treatment of Hydrogen Combustion Engines. Topics in Catalysis, 66 (13-14), 973–984. doi:10.1007/s11244-022-01723-1
Farpón, M. G.; Henao, W.; Plessow, P. N.; Andrés, E.; Arenal, R.; Marini, C.; Agostini, G.; Studt, F.; Prieto, G. (2022). Rhodium Single‐Atom Catalyst Design through Oxide Support Modulation for Selective Gas‐Phase Ethylene Hydroformylation. Angewandte Chemie - International Edition, 62 (1), Art.-Nr.: e202214048. doi:10.1002/anie.202214048
Zimmermann, J.; Chiaberge, S.; Iversen, S. B.; Raffelt, K.; Dahmen, N. (2022). Sequential Extraction and Characterization of Nitrogen Compounds after Hydrothermal Liquefaction of Sewage Sludge. Energy & Fuels, 36 (23), 14292–14303. doi:10.1021/acs.energyfuels.2c02622
Chen, S.; Huang, X.; Schild, D.; Wang, D.; Kübel, C.; Behrens, S. (2022). Pd–In intermetallic nanoparticles with high catalytic selectivity for liquid-phase semi-hydrogenation of diphenylacetylene. Nanoscale, 14 (47), 17661–17669. doi:10.1039/D2NR03674F
Perret, L.; Boukis, N.; Sauer, J. (2022). Methods of reaction and reactor engineering to adjust product ratios and increase efficiency of syngas fermentation with Clostridium ljungdahlii. Chemie Ingenieur Technik, 94 (9), 1252. doi:10.1002/cite.202255034
Seitz, L. C.; Doronkin, D. E.; Hauschild, D.; Casapu, M.; Zengel, D.; Zimina, A.; Kreikemeyer-Lorenzo, D.; Blum, M.; Yang, W.; Grunwaldt, J.-D.; Heske, C.; Weinhardt, L. (2022). Direct Observation of Reactant, Intermediate, and Product Species for Nitrogen Oxide-Selective Catalytic Reduction on Cu-SSZ-13 Using In Situ Soft X-ray Spectroscopy. The Journal of Physical Chemistry C, 126 (49), 20998–21009. doi:10.1021/acs.jpcc.2c04736
Kuhn, C.; Düll, A.; Rohlfs, P.; Tischer, S.; Börnhorst, M.; Deutschmann, O. (2022). Iron as recyclable energy carrier: Feasibility study and kinetic analysis of iron oxide reduction. Applications in Energy and Combustion Science, 12, Art.-Nr.: 100096. doi:10.1016/j.jaecs.2022.100096
Treu, P.; Huber, P.; Plessow, P. N.; Studt, F.; Saraçi, E. (2022). Lewis acid Sn-Beta catalysts for the cycloaddition of isoprene and methyl acrylate: a greener route to bio-derived monomers. Catalysis Science & Technology, 12 (24), 7439–7447. doi:10.1039/D2CY01337A
Sun, X.; Yu, J.; Cao, S.; Zimina, A.; Sarma, B. B.; Grunwaldt, J.-D.; Xu, H.; Li, S.; Liu, Y.; Sun, J. (2022). In Situ Investigations on Structural Evolutions during the Facile Synthesis of Cubic α-MoC
Guo, B.; Hornung, U.; Zhang, S.; Dahmen, N. (2022). Techno‐Economic Assessment of a Microalgae Biorefinery. Chemie Ingenieur Technik, 95 (6), 950–954. doi:10.1002/cite.202200007
Denisov, N.; Qin, S.; Will, J.; Vasiljevic, B. N.; Skorodumova, N. V.; Pašti, I. A.; Sarma, B. B.; Osuagwu, B.; Yokosawa, T.; Voss, J.; Wirth, J.; Spiecker, E.; Schmuki, P. (2022). Light‐induced agglomeration of single‐atom platinum in photocatalysis. Advanced Materials, 35 (5), Art.-Nr.: 2206569. doi:10.1002/adma.202206569
Fan, Y.; Hoffmann, A.; Hornung, U.; Raffelt, K.; Zevaco, T. A.; Dahmen, N. (2022). Hydrothermal, catalyst-free production of a cyclic dipeptide from lysine. Journal of Analytical and Applied Pyrolysis, 168, Art.-Nr.: 105792. doi:10.1016/j.jaap.2022.105792
Visser, N. L.; Daoura, O.; Plessow, P. N.; Smulders, L. C. J.; Rijk, J. W. de; de Rijk, J. W.; Stewart, J. A.; Vandegehuchte, B. D.; Studt, F.; van der Hoeven, J. E. S. (2022). Particle Size Effects of Carbon Supported Nickel Nanoparticles for High Pressure CO 2 Methanation. ChemCatChem, 14 (22), Art.Nr. e202200665. doi:10.1002/cctc.202200665
Aitbekova, A.; Zhou, C.; Stone, M. L.; Lezama-Pacheco, J. S.; Yang, A.-C.; Hoffman, A. S.; Goodman, E. D.; Huber, P.; Stebbins, J. F.; Bustillo, K. C.; Ercius, P.; Ciston, J.; Bare, S. R.; Pleßow, P. N.; Cargnello, M. (2022). Templated encapsulation of platinum-based catalysts promotes high-temperature stability to 1,100 °C. Nature Materials, 21 (11), 1290–1297. doi:10.1038/s41563-022-01376-1
Borchers, M.; Thrän, D.; Chi, Y.; Dahmen, N.; Dittmeyer, R.; Dolch, T.; Dold, C.; Förster, J.; Herbst, M.; Heß, D.; Kalhori, A.; Koop-Jakobsen, K.; Li, Z.; Mengis, N.; Reusch, T. B. H.; Rhoden, I.; Sachs, T.; Schmidt-Hattenberger, C.; Stevenson, A.; Thoni, T.; Wu, J.; Yeates, C. (2022). Scoping carbon dioxide removal options for Germany–What is their potential contribution to Net-Zero CO
Marchuk, V.; Huang, X.; Murzin, V.; Grunwaldt, J.-D.; Doronkin, D. E. (2022). Operando QEXAFS Study of Pt–Fe Ammonia Slip Catalysts During Realistic Driving Cycles. Topics in Catalysis, 66 (13-14), 825–838. doi:10.1007/s11244-022-01718-y
Fonseca, F. G.; Anca-Couce, A.; Funke, A.; Dahmen, N. (2022). Challenges in Kinetic Parameter Determination for Wheat Straw Pyrolysis. Energies, 15 (19), Art.-Nr.: 7240. doi:10.3390/en15197240
Betz, M.; Fuchs, C.; Zevaco, T. A.; Arnold, U.; Sauer, J. (2022). Production of hydrocarbon fuels by heterogeneously catalyzed oligomerization of ethylene: Tuning of the product distribution. Biomass and Bioenergy, 166, Art.-Nr.: 106595. doi:10.1016/j.biombioe.2022.106595
Perret, L.; Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Zevaco, T. A.; Neumann, A.; Sauer, J. (2022). CO
Tikhonov, D. S.; Scutelnic, V.; Sharapa, D. I.; Krotova, A. A.; Dmitrieva, A. V.; Obenchain, D. A.; Schnell, M. (2022). Structures of the (Imidazole)nH+ . Ar (n=1,2,3) complexes determined from IR spectroscopy and quantum chemical calculations. Structural Chemistry, 34 (1), 203–213. doi:10.1007/s11224-022-02053-4
Schumann, M.; Grunwaldt, J.-D.; Jensen, A. D.; Christensen, J. M. (2022). Investigations of mechanism, surface species and support effects in CO hydrogenation over Rh. Journal of Catalysis, 414, 90–100. doi:10.1016/j.jcat.2022.08.031
Czioska, S.; Ehelebe, K.; Geppert, J.; Escalera-López, D.; Boubnov, A.; Saraçi, E.; Mayerhöfer, B.; Krewer, U.; Cherevko, S.; Grunwaldt, J.-D. (2022). Heating up the OER: Investigation of IrO₂ OER Catalysts as Function of Potential and Temperature. ChemElectroChem, 9 (19), e202200514. doi:10.1002/celc.202200514
Kreitz, B.; Lott, P.; Bae, J.; Blöndal, K.; Angeli, S.; Ulissi, Z. W.; Studt, F.; Goldsmith, C. F.; Deutschmann, O. (2022). Detailed Microkinetics for the Oxidation of Exhaust Gas Emissions through Automated Mechanism Generation. ACS Catalysis, 12 (18), 11137–11151. doi:10.1021/acscatal.2c03378
Keller, K.; Wan, S.; Borchers, M.; Lott, P.; Suntz, R.; Deutschmann, O.; Wan, S. (2022). Treating NOx emission of hydrogen fueled combustion engines by NOx storage and reduction catalysts: A transient kinetic study including PLIF measurements. Proceedings of the Combustion Institute, 39 (4), 4247–4256. doi:10.1016/j.proci.2022.07.027
Popov, I.; Bügel, P.; Kozlowska, M.; Fink, K.; Studt, F.; Sharapa, D. I. (2022). Analytical Model of CVD Growth of Graphene on Cu(111) Surface. Nanomaterials, 12 (17), Art.Nr. 2963. doi:10.3390/nano12172963
Weyhing, T.; Koch, T.; Wagner, U.; Dahmen, N. (2022). G40 - Ein Schritt zu einem CO
Lacerda de Oliveira Campos, B.; John, K.; Beeskow, P.; Herrera Delgado, K.; Pitter, S.; Dahmen, N.; Sauer, J. (2022). A Detailed Process and Techno-Economic Analysis of Methanol Synthesis from H₂ and CO₂ with Intermediate Condensation Steps. Processes, 10 (8), Art.-Nr.: 1535. doi:10.3390/pr10081535
Barberis, L.; Hakimioun, A. H.; Plessow, P. N.; Visser, N. L.; Stewart, J. A.; Vandegehuchte, B. D.; Studt, F.; Jongh, P. E. de. (2022). Competition between reverse water gas shift reaction and methanol synthesis from CO 2 : influence of copper particle size. Nanoscale, 14 (37), 13551–13560. doi:10.1039/d2nr02612k
Das, S.; Pashminehazar, R.; Sharma, S.; Weber, S.; Sheppard, T. L. (2022). New Dimensions in Catalysis Research with Hard X‐Ray Tomography. Chemie Ingenieur Technik, 94 (11), 1591–1610. doi:10.1002/cite.202200082
Treu, P.; Sarma, B. B.; Grunwaldt, J.-D.; Saraçi, E. (2022). Oxidative cleavage of vicinal diols catalyzed by monomeric Fe‐sites inside MFI zeolite. ChemCatChem, 14 (21), e202200993. doi:10.1002/cctc.202200993
De Wispelaere, K.; Plessow, P. N.; Studt, F. (2022). Toward Computing Accurate Free Energies in Heterogeneous Catalysis: a Case Study for Adsorbed Isobutene in H-ZSM-5. ACS Physical Chemistry Au, 2 (5), 399–406. doi:10.1021/acsphyschemau.2c00020
Fan, Y.; Prestigiacomo, C.; Gong, M.; Tietz, T.; Hornung, U.; Dahmen, N. (2022). Comparative investigation on the value-added products obtained from continuous and batch hydrothermal liquefaction of sewage sludge. Frontiers in Environmental Science, 10, Art.Nr. 996353. doi:10.3389/fenvs.2022.996353
Fan, Y.; Hornung, U.; Dahmen, N. (2022). Hydrothermal liquefaction of sewage sludge for biofuel application: A review on fundamentals, current challenges and strategies. Biomass and Bioenergy, 165, Art.-Nr.: 106570. doi:10.1016/j.biombioe.2022.106570
Su, Y.; Guo, B.; Hornung, U.; Dahmen, N. (2022). FeCl₃-supported solvothermal liquefaction of Miscanthus in methanol. Energy, 258, Art.-Nr.: 124971. doi:10.1016/j.energy.2022.124971
Prestigiacomo, C.; Zimmermann, J.; Hornung, U.; Raffelt, K.; Dahmen, N.; Scialdone, O.; Galia, A. (2022). Effect of transition metals and homogeneous hydrogen producers in the hydrothermal liquefaction of sewage sludge. Fuel Processing Technology, 237, Art.-Nr.: 107452. doi:10.1016/j.fuproc.2022.107452
Drexler, M.; Haltenort, P.; Arnold, U.; Sauer, J.; Karakoulia, S. A.; Triantafyllidis, K. S. (2022). Progress in the anhydrous production of oxymethylene ethers (OME) as a renewable diesel fuel in a liquid phase process. Catalysis Today, 424, Art.-Nr.: 113847. doi:10.1016/j.cattod.2022.07.015
Geppert, J.; Röse, P.; Czioska, S.; Escalera-López, D.; Boubnov, A.; Saraçi, E.; Cherevko, S.; Grunwaldt, J.-D.; Krewer, U. (2022). Microkinetic Analysis of the Oxygen Evolution Performance at Different Stages of Iridium Oxide Degradation. Journal of the American Chemical Society, 144 (29), 13205–13217. doi:10.1021/jacs.2c03561
Campos Fraga, M. M.; Lacerda de Oliveira Campos, B.; Hendrawidjaja, H.; Carriel Schmitt, C.; Raffelt, K.; Dahmen, N. (2022). Fast Pyrolysis Oil Upgrading via HDO with Fe-Promoted Nb₂O₅-Supported Pd-Based Catalysts. Energies, 15 (13), Art.-Nr.: 4762. doi:10.3390/en15134762
Bagheri, M.; Stumpf, B.; Roisman, I. V.; Dadvand, A.; Wörner, M.; Marschall, H. (2022). A unified finite volume framework for phase‐field simulations of an arbitrary number of fluid phases. The Canadian Journal of Chemical Engineering, 100 (9), 2291–2308. doi:10.1002/cjce.24510
Wan, S.; Keller, K.; Lott, P.; Shirsath, A. B.; Tischer, S.; Häber, T.; Suntz, R.; Deutschmann, O. (2022). Experimental and numerical investigation of NO oxidation on Pt/Al₂ O₃- and NOₓ storage on Pt/BaO/Al₂ O₃-catalysts. Catalysis Science & Technology, 12 (14), 4456–4470. doi:10.1039/d2cy00572g
Qin, S.; Denisov, N.; Sarma, B. B.; Hwang, I.; Doronkin, D. E.; Tomanec, O.; Kment, S.; Schmuki, P. (2022). Pt Single Atoms on TiO 2 Polymorphs—Minimum Loading with a Maximized Photocatalytic Efficiency. Advanced Materials Interfaces, 9 (22), Art.-Nr.: 2200808. doi:10.1002/admi.202200808
Feofanov, M.; Sharapa, D. I.; Akhmetov, V. (2022). Alumina-mediated soft propargylic C–H activation in unactivated alkynes. Green Chemistry, 24 (12), 4761–4765. doi:10.1039/d2gc00555g
Schulte, M.; Weber, S.; Klag, L.; Grunwaldt, J.-D.; Sheppard, T. L. (2022). Synchrotron PXRD deconvolutes nickel particle and support changes in Ni/ZrO
Plessow, P. N.; Enss, A. E.; Huber, P.; Studt, F. (2022). A new mechanistic proposal for the aromatic cycle of the MTO process based on a computational investigation for H-SSZ-13. Catalysis Science and Technology, 12 (11), 3516–3523. doi:10.1039/D2CY00021K
Kohansal, K.; Sharma, K.; Haider, M. S.; Toor, S. S.; Castello, D.; Rosendahl, L. A.; Zimmermann, J.; Pedersen, T. H. (2022). Hydrotreating of bio-crude obtained from hydrothermal liquefaction of biopulp: effects of aqueous phase recirculation on the hydrotreated oil. Sustainable Energy and Fuels, 6 (11), 2805–2822. doi:10.1039/D2SE00399F
Zheng, L.; Casapu, M.; Grunwaldt, J.-D. (2022). Understanding the multiple interactions in vanadium-based SCR catalysts during simultaneous NO
Abel, K. L.; Weber, S.; Poppitz, D.; Titus, J.; Sheppard, T. L.; Gläser, R. (2022). Thermally stable mesoporous tetragonal zirconia through surfactant-controlled synthesis and Si-stabilization. RSC Advances, 12 (26), 16875–16885. doi:10.1039/d2ra01459a
Amsler, J.; Bernart, S.; Plessow, P. N.; Studt, F. (2022). Theoretical investigation of the olefin cycle in H-SSZ-13 for the ethanol-to-olefins process using ab initio calculations and kinetic modeling. Catalysis Science and Technology, 12 (10), 3311–3321. doi:10.1039/D1CY02289J
Koutsonikolas, D.; Karagiannakis, G.; Plakas, K.; Chatzis, V.; Skevis, G.; Giudicianni, P.; Amato, D.; Sabia, P.; Boukis, N.; Stoll, K. (2022). Membrane and Electrochemical Based Technologies for the Decontamination of Exploitable Streams Produced by Thermochemical Processing of Contaminated Biomass. Energies, 15 (7), Art. Nr.: 2683. doi:10.3390/en15072683
Karp, S. G.; Schmitt, C. C.; Moreira, R.; de Oliveira Penha, R.; de Mello, A. F. M.; Herrmann, L. W.; Soccol, C. R. (2022). Sugarcane Biorefineries: Status and Perspectives in Bioeconomy. BioEnergy Research, 15, 1842–1853. doi:10.1007/s12155-022-10406-4
Wang, J.; Sauter, E.; Nefedov, A.; Heißler, S.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D.; Wang, Y.; Wöll, C. (2022). Dynamic Structural Evolution of Ceria-Supported Pt Particles: A Thorough Spectroscopic Study. The Journal of Physical Chemistry C, 126 (21), 9051–9058. doi:10.1021/acs.jpcc.2c02420
Akhmetov, V.; Feofanov, M.; Ruppenstein, C.; Lange, J.; Sharapa, D.; Krstić, M.; Hampel, F.; Kataev, E. A.; Amsharov, K. (2022). Acenaphthenoannulation Induced by the Dual Lewis Acidity of Alumina. Chemistry - A European Journal, 28 (31), e202200584. doi:10.1002/chem.202200584
Huber, P.; Studt, F.; Plessow, P. N. (2022). Reactivity of Surface Lewis and Brønsted Acid Sites in Zeolite Catalysis: A Computational Case Study of DME Synthesis Using H-SSZ-13. The Journal of Physical Chemistry C, 126 (13), 5896–5905. doi:10.1021/acs.jpcc.2c00668
Seid, N.; Griesheimer, P.; Neumann, A. (2022). Investigating the Processing Potential of Ethiopian Agricultural Residue Enset/Ensete ventricosum for Biobutanol Production. Bioengineering, 9 (4), Art.-Nr.: 133. doi:10.3390/bioengineering9040133
Plessow, P. N.; Campbell, C. T. (2022). Influence of Adhesion on the Chemical Potential of Supported Nanoparticles as Modeled with Spherical Caps. ACS Catalysis, 12 (4), 2302–2308. doi:10.1021/acscatal.1c04633
Neukum, D.; Baumgarten, L.; Wüst, D.; Sarma, B. B.; Saraçi, E.; Kruse, A.; Grunwaldt, J.-D. (2022). Challenges of green FDCA production from bio‐derived HMF: Overcoming deactivation by concomitant amino acids. ChemSusChem, 15 (13), e202200418. doi:10.1002/cssc.202200418
Sarmah, N.; Sharma, D.; Mehta, B. K.; Shrivastava, B. D.; Das, B. K.; Zimina, A.; Gaur, A. (2022). Probing the electronic nature of Co centers forming the planar ring in octa-nuclear Co complexes using X-ray absorption spectroscopy. Journal of Molecular Structure, 1263, Art.-Nr.: 133125. doi:10.1016/j.molstruc.2022.133125
Grafmüller, J.; Böhm, A.; Zhuang, Y.; Spahr, S.; Müller, P.; Otto, T. N.; Bucheli, T. D.; Leifeld, J.; Giger, R.; Tobler, M.; Schmidt, H.-P.; Dahmen, N.; Hagemann, N. (2022). Wood Ash as an Additive in Biomass Pyrolysis: Effects on Biochar Yield, Properties, and Agricultural Performance. ACS Sustainable Chemistry & Engineering, 10 (8), Artk.Nr.: 2720–2729. doi:10.1021/acssuschemeng.1c07694
Delgado Otalvaro, N.; Bilir, P. G.; Herrera Delgado, K.; Pitter, S.; Sauer, J. (2022). Kinetics of the Direct DME Synthesis: State of the Art and Comprehensive Comparison of Semi-Mechanistic, Data-Based and Hybrid Modeling Approaches. Catalysts, 12 (3), Art.-Nr.: 347. doi:10.3390/catal12030347
Zhao, D.; Guo, K.; Han, S.; Doronkin, D. E.; Lund, H.; Li, J.; Grunwaldt, J.-D.; Zhao, Z.; Xu, C.; Jiang, G.; Kondratenko, E. V. (2022). Controlling Reaction-Induced Loss of Active Sites in ZnOₓ/Silicalite-1 for Durable Nonoxidative Propane Dehydrogenation. ACS Catalysis, 12 (8), 4608–4617. doi:10.1021/acscatal.1c05778
Santos, T. M.; Silva, W. R. da; Carregosa, J. de C.; Schmitt, C. C.; Moreira, R.; Raffelt, K.; Dahmen, N.; Wisniewski, A., Jr. (2022). Thermal Conversion of Sugarcane Bagasse Coupled with Vapor Phase Hydrotreatment over Nickel-Based Catalysts: A Comprehensive Characterization of Upgraded Products. Catalysts, 12 (4), 355. doi:10.3390/catal12040355
Baehr, C.; Smith, G. J.; Sleeman, D.; Zevaco, T. A.; Raffelt, K.; Dahmen, N. (2022). Aldehydes and ketones in pyrolysis oil: analytical determination and their role in the aging process. RSC Advances, 12 (12), 7374–7382. doi:10.1039/D1RA08899H
Sayegh, A.; Merkert, S.; Zimmermann, J.; Horn, H.; Saravia, F. (2022). Treatment of Hydrothermal-Liquefaction Wastewater with Crossflow UF for Oil and Particle Removal. Membranes, 12 (3), Art.-Nr.: 255. doi:10.3390/membranes12030255
Eggart, D.; Huang, X.; Zimina, A.; Yang, J.; Pan, Y.; Pan, X.; Grunwaldt, J.-D. (2022). Operando XAS Study of Pt-Doped CeO2 for the Nonoxidative Conversion of Methane. ACS Catalysis, 12, 3897–3908. doi:10.1021/acscatal.2c00092
Yang, Q.; Kondratenko, V. A.; Petrov, S. A.; Doronkin, D. E.; Saraçi, E.; Lund, H.; Arinchtein, A.; Kraehnert, R.; Skrypnik, A. S.; Matvienko, A. A.; Kondratenko, E. V. (2022). Identifying Performance Descriptors in CO2 Hydrogenation over Iron‐based Catalysts Promoted with Alkali Metals. Angewandte Chemie International Edition, 61 (22), Art.Nr. e202116517. doi:10.1002/anie.202116517
Bagheri, M.; Stumpf, B.; Roisman, I. V.; Tropea, C.; Hussong, J.; Wörner, M.; Marschall, H. (2022). Interfacial relaxation – Crucial for phase-field methods to capture low to high energy drop-film impacts. International Journal of Heat and Fluid Flow, 94, Art.-Nr.: 108943. doi:10.1016/j.ijheatfluidflow.2022.108943
Banivaheb, S.; Pitter, S.; Delgado, K. H.; Rubin, M.; Sauer, J.; Dittmeyer, R. (2022). Recent Progress in Direct DME Synthesis and Potential of Bifunctional Catalysts. Chemie - Ingenieur - Technik, 94 (3), 240–255. doi:10.1002/cite.202100167
Weber, S.; Zimmermann, R. T.; Bremer, J.; Abel, K. L.; Poppitz, D.; Prinz, N.; Ilsemann, J.; Wendholt, S.; Yang, Q.; Pashminehazar, R.; Monaco, F.; Cloetens, P.; Huang, X.; Kübel, C.; Kondratenko, E.; Bauer, M.; Bäumer, M.; Zobel, M.; Gläser, R.; Sundmacher, K.; Sheppard, T. L. (2022). Digitization in Catalysis Research: Towards a Holistic Description of a Ni/Al2O3 Reference Catalyst for CO2 Methanation. ChemCatChem, 14 (8), e202101878. doi:10.1002/cctc.202101878
Maurer, F.; Beck, A.; Jelic, J.; Wang, W.; Mangold, S.; Stehle, M.; Wang, D.; Dolcet, P.; Gänzler, A. M.; Kübel, C.; Studt, F.; Casapu, M.; Grunwaldt, J.-D. (2022). Surface Noble Metal Concentration on Ceria as a Key Descriptor for Efficient Catalytic CO Oxidation. ACS catalysis, 12, 2473–2486. doi:10.1021/acscatal.1c04565
Drexler, M.; Haltenort, P.; Arnold, U.; Sauer, J. (2022). Continuous Synthesis of Oxymethylene Ether Fuels from Dimethyl Ether in a Heterogeneously Catalyzed Liquid Phase Process. Chemie-Ingenieur-Technik, 94 (3), 256–266. doi:10.1002/cite.202100173
Wang, S.; Rohlfs, P.; Börnhorst, M.; Schillaci, A.; Marschall, H.; Deutschmann, O.; Wörner, M. (2022). Bubble Cutting by Cylinder – Elimination of Wettability Effects by a Separating Liquid Film. Chemie-Ingenieur-Technik, 94 (3), 385–392. doi:10.1002/cite.202100145
Krstić, M.; Fink, K.; Sharapa, D. I. (2022). The Adsorption of Small Molecules on the Copper Paddle-Wheel: Influence of the Multi-Reference Ground State. Molecules, 27 (3), Art.-Nr.: 912. doi:10.3390/molecules27030912
Chawla, J.; Schardt, S.; Angeli, S.; Lott, P.; Tischer, S.; Maier, L.; Deutschmann, O. (2022). Oxidative Coupling of Methane over Pt/Al
Guse, D.; Polierer, S.; Wild, S.; Pitter, S.; Kind, M. (2022). Improved Preparation of Cu/Zn‐Based Catalysts by Well‐Defined Conditions of Co‐Precipitation and Aging. Chemie - Ingenieur - Technik, 94 (3), 314–327. doi:10.1002/cite.202100197
Uzunidis, G.; Behrens, S. (2022). Pd/Ag Nanoparticles Prepared in Ionic Liquids as Model Catalysts for the Hydrogenation of Diphenylacetylene . Chemie - Ingenieur - Technik, 94 (3), 328–339. doi:10.1002/cite.202100163
Wild, S.; Lacerda de Oliveira Campos, B.; Zevaco, T. A.; Guse, D.; Kind, M.; Pitter, S.; Herrera Delgado, K.; Sauer, J. (2022). Experimental investigations and model-based optimization of CZZ/H-FER 20 bed compositions for the direct synthesis of DME from CO
Kirchberger, F. M.; Liu, Y.; Plessow, P. N.; Tonigold, M.; Studt, F.; Sanchez-Sanchez, M.; Lercher, J. A. (2022). Mechanistic differences between methanol and dimethyl ether in zeolite-catalyzed hydrocarbon synthesis. Proceedings of the National Academy of Sciences of the United States of America, 119 (4), Art.-Nr. e2103840119. doi:10.1073/pnas.2103840119
Weber, S.; Diaz, A.; Holler, M.; Schropp, A.; Lyubomirskiy, M.; Abel, K. L.; Kahnt, M.; Jeromin, A.; Kulkarni, S.; Keller, T. F.; Gläser, R.; Sheppard, T. L. (2022). Evolution of Hierarchically Porous Nickel Alumina Catalysts Studied by X‐Ray Ptychography. Advanced science, 9 (8), 2105432. doi:10.1002/advs.202105432
Guo, B.; Yang, B.; Weil, P.; Zhang, S.; Hornung, U.; Dahmen, N. (2022). The Effect of Dichloromethane on Product Separation during Continuous Hydrothermal Liquefaction of Chlorella vulgaris and Aqueous Product Recycling for Algae Cultivation. Energy & fuels, 36 (2), 922–931. doi:10.1021/acs.energyfuels.1c02523
Gaur, A.; Stehle, M.; Serrer, M.-A.; Stummann, M. Z.; La Fontaine, C.; Briois, V.; Grunwaldt, J.-D.; Høj, M. (2022). Using Transient XAS to Detect Minute Levels of Reversible S-O Exchange at the Active Sites of MoS2-Based Hydrotreating Catalysts: Effect of Metal Loading, Promotion, Temperature, and Oxygenate Reactant. ACS catalysis, 12 (1), 633–647. doi:10.1021/acscatal.1c04767
Trinkies, L. L.; Düll, A.; Zhang, J.; Urban, S.; Deschner, B. J.; Kraut, M.; Ladewig, B. P.; Weltin, A.; Kieninger, J.; Dittmeyer, R. (2022). Investigation of mass transport processes in a microstructured membrane reactor for the direct synthesis of hydrogen peroxide. Chemical engineering science, 248, Ar. Nr.: 117145. doi:10.1016/j.ces.2021.117145
Guo, B.; Yang, B.; Su, Y.; Zhang, S.; Hornung, U.; Dahmen, N. (2022). Screening and Optimization of Microalgae Biomass and Plastic Material Coprocessing by Hydrothermal Liquefaction. ACS ES&T Engineering, 2 (1), 65–77. doi:10.1021/acsestengg.1c00261
Tofighi, G.; Lichtenberg, H.; Gaur, A.; Wang, W.; Wild, S.; Herrera Delgado, K.; Pitter, S.; Dittmeyer, R.; Grunwaldt, J.-D.; Doronkin, D. E. (2022). Continuous Synthesis of Cu/ZnO/Al2O3 Nanoparticles in a Co-precipitation Reaction Using a Silicon Based Microfluidic Reactor. Reaction chemistry & engineering, 7 (3), 730–740. doi:10.1039/D1RE00499A
Mantei, F.; Ali, R. E.; Baensch, C.; Voelker, S.; Haltenort, P.; Burger, J.; Dietrich, R.-U.; Assen, N. von der; Schaadt, A.; Sauer, J.; Salem, O. (2022). Techno-economic assessment and carbon footprint of processes for the large-scale production of oxymethylene dimethyl ethers from carbon dioxide and hydrogen. Sustainable energy & fuels, 6 (3), 528–549. doi:10.1039/D1SE01270C
Pandit, L.; Serrer, M.-A.; Saraҫi E.; Boubnov, A.; Grunwaldt, J.-D. (2022). Versatile in situ/operando Setup for Studying Catalysts by X-Ray Absorption Spectroscopy under Demanding and Dynamic Reaction Conditions for Energy Storage and Conversion. Chemistry methods, 2 (1), e202100078. doi:10.1002/cmtd.202100078
Liu, S.; Yang, C.; Zha, S.; Sharapa, D.; Studt, F.; Zhao, Z.-J.; Gong, J. (2022). Moderate Surface Segregation Promotes Selective Ethanol Production in CO
Li, H.; Jelic, J.; Studt, F. (2022). The barrier free splitting of O-H bond in H
Yu, S.; Guo, B.; Johnsen, S.; Wiegand, G.; Lemmer, U.; Guo, X.; Zhang, M.; Li, Y.; Sprau, C.; Hölscher, H.; Colsmann, A.; Gomard, G. (2022). Nanoporous Polymer Reflectors for Organic Solar Cells. Energy technology, 10 (2), Art.-Nr. 2100676. doi:10.1002/ente.202100676
Stehle, M.; Gaur, A.; Weber, S.; Sheppard, T. L.; Thomann, M.; Fischer, A.; Grunwaldt, J.-D. (2022). Complementary operando insights into the activation of multicomponent selective propylene oxidation catalysts. Journal of catalysis, 408, 339–355. doi:10.1016/j.jcat.2021.08.053
Ma, M.; Huang, Z.; Doronkin, D. E.; Fa, W.; Rao, Z.; Zou, Y.; Wang, R.; Zhong, Y.; Cao, Y.; Zhang, R.; Zhou, Y. (2022). Ultrahigh surface density of Co-N₂C single-atom-sites for boosting photocatalytic CO₂ reduction to methanol. Applied catalysis / B, 300, Art.-Nr.: 120695. doi:10.1016/j.apcatb.2021.120695
Wollak, B.; Doronkin, D. E.; Espinoza, D.; Sheppard, T.; Korup, O.; Schmidt, M.; Alizadefanaloo, S.; Rosowski, F.; Schroer, C.; Grunwaldt, J.-D.; Horn, R. (2022). Exploring Catalyst Dynamics in a Fixed Bed Reactor by Correlative Operando Spatially-Resolved Structure-Activity Profiling. Journal of catalysis, 408, 372–387. doi:10.1016/j.jcat.2021.08.029
Soares Dias, A. P.; Gomes Fonseca, F.; Catarino, M.; Gomes, J. (2022). Biodiesel Glycerin Valorization into Oxygenated Fuel Additives. Catalysis Letters, 152, 513–522. doi:10.1007/s10562-021-03646-0
Şen, A. U.; Fonseca, F. G.; Funke, A.; Pereira, H.; Lemos, F. (2022). Pyrolysis kinetics and estimation of chemical composition of Quercus cerris cork. Biomass Conversion and Biorefinery, 12, 4835–4845. doi:10.1007/s13399-020-00964-y
Mrosk, C.; Kolb, T.; Stapf, D.; Sauer, J. (2022). CarbonCycleLab: Wasserstoff für die Circular Economy = CarbonCycleLab: Hydrogen for the Circular Economy. LookIT. LookKIT : Das Magazin für Forschung, Lehre, Innovation, (01/2022), 38–41.
2021
Book Chapters
Semmel, M.; Ali, R. E.; Ouda, M.; Schaadt, A.; Sauer, J.; Hebling, C. (2021). Power-to-DME: a cornerstone towards a sustainable energy system. Power to Fuel., 123–151, Elsevier. doi:10.1016/B978-0-12-822813-5.00010-2
Dolcet, P.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D. (2021). Tracking the evolution of Pt single sites on CeO2. ESRF Highlights 2020, 123–125.
Journal Articles
Yang, C.; Cao, Y.; Plessow, P. N.; Wang, J.; Nefedov, A.; Heissler, S.; Studt, F.; Wang, Y.; Idriss, H.; Mayerhöfer, T. G.; Wöll, C. (2021). N
Sarma, B. B.; Agostini, G.; Farpón, M. G.; Marini, C.; Pfänder, N.; Prieto, G. (2021). Bottom-up assembly of bimetallic nanocluster catalysts from oxide-supported single-atom precursors. Journal of materials chemistry / A, 9 (13), 8401–8415. doi:10.1039/d1ta00421b
Kim, Y. Y.; Keller, T. F.; Goncalves, T. J.; Abuin, M.; Runge, H.; Gelisio, L.; Carnis, J.; Vonk, V.; Plessow, P. N.; Vartaniants, I. A.; Stierle, A. (2021). Single alloy nanoparticle x-ray imaging during a catalytic reaction. Science advances, 7 (40), Art.Nr.: eabh0757. doi:10.1126/sciadv.abh0757
Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Pitter, S.; Sauer, J. (2021). Development of Consistent Kinetic Models Derived from a Microkinetic Model of the Methanol Synthesis. Industrial & engineering chemistry research, 60 (42), 15074–15086. doi:10.1021/acs.iecr.1c02952
Wang, X.; Funke, A.; Cheng, Y.-J.; Song, F.; Yin, S.; Liang, S.; Zuo, X.; Gao, J.; Müller-Buschbaum, P.; Xia, Y. (2021). Continuous fast pyrolysis synthesis of TiO₂/C nanohybrid lithium-ion battery anode. Nano select, 2 (9), 1770–1778. doi:10.1002/nano.202100015
Schmitt, C. C.; Fonseca, F. G.; Fraga, M. M. C.; Wisniewski, J., Alberto; Karp, S.; José, Á. H. M.; Rodrigues, R. C. L. B. L.; Moreira, R.; Hirayama, D. E.; Raffelt, K.; Dahmen, N. (2021). Thermochemical and catalytic conversion technologies for the development of Brazilian biomass utilization. Catalysts, 11 (12), 1549. doi:10.3390/catal11121549
Freund, H.; Sauer, J.; Wachsen, O. (2021). „Circular Economy” – ein neues und zugleich altes Arbeitsgebiet der Reaktionstechnik. Chemie - Ingenieur - Technik, 93 (5), 735. doi:10.1002/cite.202170502
Samkhaniani, N.; Marschall, H.; Stroh, A.; Frohnapfel, B.; Wörner, M. (2021). Numerical simulation of drop impingement and bouncing on a heated hydrophobic surface. Journal of Physics: Conference Series, 2116 (1), Art.-Nr.: 012073. doi:10.1088/1742-6596/2116/1/012073
Lacková, V.; Schroer, M. A.; Honecker, D.; Hähsler, M.; Vargová, H.; Zakutanská, K.; Behrens, S.; Kováč, J.; Svergun, D. I.; Kopčanský, P.; Tomašovičová, N. (2021). Clustering in ferronematics : The effect of magnetic collective ordering. iScience, 24 (12), Article no: 103493. doi:10.1016/j.isci.2021.103493
Deschner, B. J.; Doronkin, D. E.; Sheppard, T. L.; Rabsch, G.; Grunwaldt, J.-D.; Dittmeyer, R. (2021). Continuous-flow reactor setup for X-ray absorption spectroscopy of high pressure heterogeneous liquid–solid catalytic processes. Review of scientific instruments, 92 (12), Article no: 124101. doi:10.1063/5.0057011
Akhmetov, V.; Feofanov, M.; Sharapa, D. I.; Amsharov, K. (2021). Alumina-Mediated π-Activation of Alkynes. Journal of the American Chemical Society, 143 (37), 15420–15426. doi:10.1021/jacs.1c07845
Zhao, D.; Tian, X.; Doronkin, D. E.; Han, S.; Kondratenko, V. A.; Grunwaldt, J.-D.; Perechodjuk, A.; Vuong, T. H.; Rabeah, J.; Eckelt, R.; Rodemerck, U.; Linke, D.; Jiang, G.; Jiao, H.; Kondratenko, E. V. (2021). In situ formation of ZnOₓ species for efficient propane dehydrogenation. Nature <London>, 599, 234–238. doi:10.1038/s41586-021-03923-3
Straß-Eifert, A.; Sheppard, T. L.; Becker, H.; Friedland, J.; Zimina, A.; Grunwaldt, J.-D.; Güttel, R. (2021). Cobalt-based Nanoreactors in Combined Fischer-Tropsch Synthesis and Hydroprocessing: Effects on Methane and CO
Weber, S.; Batey, D.; Cipiccia, S.; Stehle, M.; Abel, K. L.; Gläser, R.; Sheppard, T. L. (2021). Harte Röntgen‐Nanotomographie zur 3D‐Analyse der Verkokung in Nickel‐basierten Katalysatoren. Angewandte Chemie, 133 (40), 21940–21945. doi:10.1002/ange.202106380
Smith, A. T.; Plessow, P. N.; Studt, F. (2021). Effect of Aluminum Siting in H-ZSM-5 on Reaction Barriers. Journal of Physical Chemistry C, 125 (37), 20373–20379. doi:10.1021/acs.jpcc.1c06670
Erdogan, S.; Schulenberg, T.; Deutschmann, O.; Wörner, M. (2021). Evaluation of models for bubble-induced turbulence by DNS and utilization in two-fluid model computations of an industrial pilot-scale bubble column. Chemical Engineering Research and Design, 175, 283–295. doi:10.1016/j.cherd.2021.09.012
Fonseca, F. G.; Soares Dias, A. P. (2021). Almond shells: Catalytic fixed-bed pyrolysis and volatilization kinetics. Renewable Energy, 180, 1380–1390. doi:10.1016/j.renene.2021.08.104
Delgado Otalvaro, N.; Sogne, G.; Herrera Delgado, K.; Wild, S.; Pitter, S.; Sauer, J. (2021). Kinetics of the direct DME synthesis from CO
Smith, A. T.; Plessow, P. N.; Studt, F. (2021). Trends in the Reactivity of Proximate Aluminum Sites in H-SSZ-13. Journal of Physical Chemistry C, 125 (30), 16508–16515. doi:10.1021/acs.jpcc.1c03509
Warmuth, L.; Nails, G.; Casapu, M.; Wang, S.; Behrens, S.; Grunwaldt, J.-D.; Feldmann, C. (2021). Catalytic co oxidation and H
Kohansal, K.; Sharma, K.; Toor, S. S.; Sanchez, E. L.; Zimmermann, J.; Aistrup Rosendahl, L.; Pedersen, T. H. (2021). Bio-Crude Production Improvement during Hydrothermal Liquefaction of Biopulp by Simultaneous Application of Alkali Catalysts and Aqueous Phase Recirculation. Energies, 14 (15), Art.-Nr.: 4492. doi:10.3390/en14154492
Doronkin, D. E.; Casapu, M. (2021). Present Challenges in Catalytic Emission Control for Internal Combustion Engines. Catalysts, 11 (9), Art.-Nr. 1019. doi:10.3390/catal11091019
Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Wild, S.; Studt, F.; Pitter, S.; Sauer, J. (2021). Correction: Surface reaction kinetics of the methanol synthesis and the water gas shift reaction on Cu/ZnO/Al
Drexler, M.; Haltenort, P.; Zevaco, T. A.; Arnold, U.; Sauer, J. (2021). Synthesis of tailored oxymethylene ether (OME) fuels via transacetalization reactions. Sustainable energy & fuels, 5 (17), 4311–4326. doi:10.1039/d1se00631b
Alizadehfanaloo, S.; Garrevoet, J.; Seyrich, M.; Murzin, V.; Becher, J.; Doronkin, D. E.; Sheppard, T. L.; Grunwaldt, J.-D.; Schroer, C. G.; Schropp, A. (2021). Tracking dynamic structural changes in catalysis by rapid 2D-XANES microscopy. Journal of synchrotron radiation, 28 (5). doi:10.1107/S1600577521007074
Uzunidis, G.; Schade, O.; Schild, D.; Grunwaldt, J.-D.; Behrens, S. (2021). Design of bimetallic Au/Cu nanoparticles in ionic liquids: Synthesis and catalytic properties in 5‐(hydroxymethyl)furfural oxidation. ChemNanoMat, 7 (10), 1108–1116. doi:10.1002/cnma.202100258
Czioska, S.; Boubnov, A.; Escalera-López, D.; Geppert, J.; Zagalskaya, A.; Röse, P.; Saraçi, E.; Alexandrov, V.; Krewer, U.; Cherevko, S.; Grunwaldt, J.-D. (2021). Increased Ir–Ir Interaction in Iridium Oxide during the Oxygen Evolution Reaction at High Potentials Probed by Operando Spectroscopy. ACS catalysis, 11 (15), 10043–10057. doi:10.1021/acscatal.1c02074
Niebel, A.; Funke, A.; Pfitzer, C.; Dahmen, N.; Weih, N.; Richter, D.; Zimmerlin, B. (2021). Fast Pyrolysis of Wheat Straw - Improvements of Operational Stability in 10 Years of Bioliq Pilot Plant Operation. Energy and Fuels, 35 (14), 11333–11345. doi:10.1021/acs.energyfuels.1c00851
Weber, S.; Batey, D.; Cipiccia, S.; Stehle, M.; Abel, K. L.; Gläser, R.; Sheppard, T. L. (2021). Hard X‐ray Nanotomography for 3D Analysis of Coking in Nickel‐based Catalysts. Angewandte Chemie / International edition, 60 (40), 21772–21777. doi:10.1002/anie.202106380
Samkhaniani, N.; Stroh, A.; Holzinger, M.; Marschall, H.; Frohnapfel, B.; Wörner, M. (2021). Bouncing drop impingement on heated hydrophobic surfaces. International journal of heat and mass transfer, 180, Art.-Nr.: 121777. doi:10.1016/j.ijheatmasstransfer.2021.121777
Gossler, S.; Ruwe, L.; Yuan, W.; Yang, J.; Chen, X.; Schmitt, S.; Maier, L.; Kohse-Höinghaus, K.; Qi, F.; Deutschmann, O. (2021). Exploring the interaction kinetics of butene isomers and NO
Dahmen, N.; Deiters, U. K.; Tuma, D. (2021). Professor Dr. rer. nat. Gerhard Manfred Schneider (May 7, 1932 – October 16, 2020): Professor and Chair of Physical Chemistry, Ruhr-University, Bochum, Germany (1969-1997). The journal of supercritical fluids, 174, Art.-Nr.: 105219. doi:10.1016/j.supflu.2021.105219
Woo, M.; Tischer, S.; Deutschmann, O.; Wörner, M. (2021). Corrigendum to “A step toward the numerical simulation of catalytic hydrogenation of nitrobenzene in Taylor flow at practical conditions” [Chem. Eng. Sci. 230 (2021) 116132]. Chemical engineering science, 234, Art.-Nr.: 116479. doi:10.1016/j.ces.2021.116479
Raupp, Y. S.; Löser, P. S.; Behrens, S.; Meier, M. A. R. (2021). Selective Catalytic Epoxide Ring-Opening of Limonene Dioxide with Water. ACS sustainable chemistry & engineering, 9 (23), 7713–7718. doi:10.1021/acssuschemeng.1c01788
Goncalves, T. J.; Plessow, P. N.; Studt, F. (2021). Theoretical Study on the NO
Schäfer, B.; Toro Chacón, F. A.; Brinkmann, T.; Drews, A.; Jochem, E.; Sauer, J. (2021). Bewertung von Energieeffizienztechnologien mit der Methodik EDUAR&D an zwei Beispielen. Chemie - Ingenieur - Technik, 93 (8), 1247–1256. doi:10.1002/cite.202000251
Henrich, E.; Dahmen, N.; Pitter, S.; Sauer, J. (2021). 30 Jahre Institut für Heiße Chemie im Kernforschungszentrum Karlsruhe [30 Years Institute for Hot Chemistry at the Nuclear Research Center Karlsruhe]. Chemie - Ingenieur - Technik, 93 (11), 1667–1687. doi:10.1002/cite.202100064
Bartenbach, D.; Wenzel, O.; Popescu, R.; Faden, L.-P.; Reiß, A.; Kaiser, M.; Zimina, A.; Grunwaldt, J.-D.; Gerthsen, D.; Feldmann, C. (2021). Liquid‐Phase Synthesis of Highly Reactive Rare‐Earth Metal Nanoparticles. Angewandte Chemie / International edition, 60 (32), 17373–17377. doi:10.1002/anie.202104955
Escalera-López, D.; Czioska, S.; Geppert, J.; Boubnov, A.; Röse, P.; Saraçi, E.; Krewer, U.; Grunwaldt, J.-D.; Cherevko, S. (2021). Phase- and Surface Composition-Dependent Electrochemical Stability of Ir-Ru Nanoparticles during Oxygen Evolution Reaction. ACS catalysis, 11 (15), 9300–9316. doi:10.1021/acscatal.1c01682
Pandit, L.; Boubnov, A.; Behrendt, G.; Mockenhaupt, B.; Chowdhury, C.; Jelic, J.; Hansen, A.-L.; Saraci, E.; Ras, E.-J.; Behrens, M.; Studt, F.; Grunwaldt, J.-D. (2021). Unravelling the Zn‐Cu Interaction during Activation of a Zn‐promoted Cu/MgO Model Methanol Catalyst. ChemCatChem, 13 (19), 4120–4132. doi:10.1002/cctc.202100692
Obeid, F.; Van, T. C.; Guo, B.; Surawski, N. C.; Hornung, U.; Brown, R. J.; Ramirez, J. A.; Thomas-Hall, S. R.; Stephens, E.; Hankamer, B.; Rainey, T. (2021). The fate of nitrogen and sulphur during co-liquefaction of algae and bagasse: Experimental and multi-criterion decision analysis. Biomass and bioenergy, 151, Art.Nr. 106119. doi:10.1016/j.biombioe.2021.106119
Mazzanti, S.; Cao, S.; ten Brummelhuis, K.; Völkel, A.; Khamrai, J.; Sharapa, D. I.; Youk, S.; Heil, T.; Tarakina, N. V.; Strauss, V.; Ghosh, I.; König, B.; Oschatz, M.; Antonietti, M.; Savateev, A. (2021). All-organic Z-scheme photoreduction of CO
Hakimioun, A. H.; Dietze, E. M.; Vandegehuchte, B. D.; Curulla-Ferre, D.; Joos, L.; Plessow, P. N.; Studt, F. (2021). Theoretical Investigation of the Size Effect on the Oxygen Adsorption Energy of Coinage Metal Nanoparticles. Catalysis letters, 151, 3165–3169. doi:10.1007/s10562-021-03567-y
Fečík, M.; Plessow, P. N.; Studt, F. (2021). Theoretical investigation of the side-chain mechanism of the MTO process over H-SSZ-13 using DFT and calculations. Catalysis science & technology, 11 (11), 3826–3833. doi:10.1039/d1cy00433f
Gaur, A.; Sharma, D.; Nitin Nair, N.; Mehta, B. K.; Shrivastava, B. D.; Gogoi, M.; Sarmah, N.; Das, B. K. (2021). Investigating cubane formation and effect of co-crystallization agents in oxo-bridged Co complexes using X-ray absorption spectroscopy. Journal of molecular structure, 1244, Art.-Nr.: 130869. doi:10.1016/j.molstruc.2021.130869
Stehle, M.; Sheppard, T. L.; Thomann, M.; Fischer, A.; Besser, H.; Pfleging, W.; Grunwaldt, J.-D. (2021). Spatial activity profiling along a fixed bed of powder catalyst during selective oxidation of propylene to acrolein. Catalysis science & technology, 11, 5781–5790. doi:10.1039/D1CY00553G
Cattaneo, S.; Capelli, S.; Stucchi, M.; Bossola, F.; Dal Santo, V.; Araujo-Lopez, E.; Sharapa, D. I.; Studt, F.; Villa, A.; Chieregato, A.; Vandegehuchte, B. D.; Prati, L. (2021). Discovering the role of substrate in aldehyde hydrogenation. Journal of Catalysis, 399, 162–169. doi:10.1016/j.jcat.2021.05.012
Hähsler, M.; Nádasi, H.; Feneberg, M.; Marino, S.; Giesselmann, F.; Behrens, S.; Eremin, A. (2021). Magnetic Tilting in Nematic Liquid Crystals Driven by Self‐Assembly. Advanced functional materials, 31 (31), Art.Nr. 2101847. doi:10.1002/adfm.202101847
Dolcet, P.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D. (2021). Insights into the Structural Dynamics of Pt/CeO
Schumann, M.; Nielsen, M. R.; Smitshuysen, T. E. L.; Hansen, T. W.; Damsgaard, C. D.; Yang, A.-C. A.; Cargnello, M.; Grunwaldt, J.-D.; Jensen, A. D.; Christensen, J. M. (2021). Rationalizing an Unexpected Structure Sensitivity in Heterogeneous Catalysis - CO Hydrogenation over Rh as a Case Study. ACS Catalysis, 11 (9), 5189–5201. doi:10.1021/acscatal.0c05002
Hoeven, J. E. S. van der; Jelic, J.; Olthof, L. A.; Totarella, G.; Dijk-Moes, R. J. A. van; Krafft, J.-M.; Louis, C.; Studt, F.; Blaaderen, A. van; Jongh, P. E. de. (2021). Unlocking synergy in bimetallic catalysts by core–shell design. Nature Materials, 20, 1216–1220. doi:10.1038/s41563-021-00996-3
Dadvand, A.; Bagheri, M.; Samkhaniani, N.; Marschall, H.; Wörner, M. (2021). Advected phase-field method for bounded solution of the Cahn–Hilliard Navier–Stokes equations. Physics of fluids, 33 (5), Art.-Nr.: 053311. doi:10.1063/5.0048614
Serrer, M.-A.; Stehle, M.; Schulte, M. L.; Besser, H.; Pfleging, W.; Saraci, E.; Grunwaldt, J.-D. (2021). Spatially‐resolved insights into local activity and structure of Ni‐based CO₂ methanation catalysts in fixed‐bed reactors. ChemCatChem, 13 (13), 3010–3020. doi:10.1002/cctc.202100490
Dahmen, N.; Sauer, J. (2021). Evaluation of techno‐economic studies on the bioliq® process for synthetic fuels production from biomass. Processes, 9 (4), Art.-Nr.: 684. doi:10.3390/pr9040684
Cao, Z.; Hülsemann, B.; Wüst, D.; Oechsner, H.; Lautenbach, A.; Kruse, A. (2021). Effect of residence time during hydrothermal carbonization of biogas digestate on the combustion characteristics of hydrochar and the biogas production of process water. Bioresource Technology, 333, Art.-Nr.: 125110. doi:10.1016/j.biortech.2021.125110
Kapuśniak, Ł.; Plessow, P. N.; Trzybiński, D.; Woźniak, K.; Hofmann, P.; Jolly, P. I. (2021). A mild one-pot reduction of phosphine(V) oxides affording phosphines(III) and their metal catalysts. Organometallics, 40, 693–701. doi:10.1021/acs.organomet.0c00788
Fečík, M.; Plessow, P. N.; Studt, F. (2021). Influence of Confinement on Barriers for Alkoxide Formation in Acidic Zeolites. ChemCatChem, 13 (10), 2451–2458. doi:10.1002/cctc.202100009
Taghipour, A.; Hornung, U.; Ramirez, J. A.; Brown, R. J.; Rainey, T. J. (2021). Fractional distillation of algae based hydrothermal liquefaction biocrude for co-processing: changes in the properties, storage stability, and miscibility with diesel. Energy Conversion and Management, 236, Art.Nr.: 114005. doi:10.1016/j.enconman.2021.114005
Amsler, J.; Plessow, P. N.; Studt, F.; Bučko, T. (2021). Anharmonic Correction to Adsorption Free Energy from DFT-Based MD Using Thermodynamic Integration. Journal of chemical theory and computation, 17 (2), 1155–1169. doi:10.1021/acs.jctc.0c01022
Studt, F. (2021). Catalysis by unusual vacancies. Nature Catalysis, 4 (3), 184–185. doi:10.1038/s41929-021-00593-2
Zimmermann, J.; Raffelt, K.; Dahmen, N. (2021). Sequential hydrothermal processing of sewage sludge to produce low nitrogen biocrude. Processes, 9 (3), Art.-Nr.: 491. doi:10.3390/pr9030491
Becher, J.; Weber, S.; Ferreira Sanchez, D.; Doronkin, D. E.; Garrevoet, J.; Falkenberg, G.; Motta Meira, D.; Pascarelli, S.; Grunwaldt, J.-D.; Sheppard, T. L. (2021). Sample Environment for Operando Hard X-ray Tomography—An Enabling Technology for Multimodal Characterization in Heterogeneous Catalysis. Catalysts, 11 (4), Art.-Nr.: 459. doi:10.3390/catal11040459
Boukis, N.; Stoll, I. K. (2021). Gasification of biomass in supercritical water, challenges for the process design—lessons learned from the operation experience of the first dedicated pilot plant. Processes, 9 (3), 1–17. doi:10.3390/pr9030455
Paul, S.; Barman, D.; Chowdhury, C.; Giri, P. K.; De, S. K. (2021). 3D/2D Bi
Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Wild, S.; Studt, F.; Pitter, S.; Sauer, J. (2021). Surface reaction kinetics of the methanol synthesis and the water gas shift reaction on Cu/ZnO/Al₂O₃. Reaction chemistry & engineering, 6 (5), 868–887. doi:10.1039/D1RE00040C
Delgado Otalvaro, N.; Gül Bilir, P.; Herrera Delgado, K.; Pitter, S.; Sauer, J. (2021). Modeling the Direct Synthesis of Dimethyl Ether using Artificial Neural Networks. Chemie - Ingenieur - Technik, 93 (5), 754–761. doi:10.1002/cite.202000226
Egeberg, A.; Faden, L.-P.; Zimina, A.; Grunwaldt, J.-D.; Gerthsen, D.; Feldmann, C. (2021). Liquid-phase Synthesis of Highly Oxophilic Zerovalent Niobium and Tantalum Nanoparticles. Chemical communications, 57, 3648–3651. doi:10.1039/D1CC00681A
Cao, Y.; Guo, L.; Dan, M.; Doronkin, D. E.; Han, C.; Rao, Z.; Liu, Y.; Meng, J.; Huang, Z.; Zheng, K.; Chen, P.; Dong, F.; Zhou, Y. (2021). Modulating electron density of vacancy site by single Au atom for effective CO
Liebertseder, M.; Wang, D.; Cavusoglu, G.; Casapu, M.; Wang, S.; Behrens, S.; Kübel, C.; Grunwaldt, J.-D.; Feldmann, C. (2021). NaCl-template-based synthesis of TiO₂-Pd/Pt hollow nanospheres for H₂O₂ direct synthesis and CO oxidation. Nanoscale, 13 (3), 2005–2011. doi:10.1039/d0nr08871d
Dietrich, C.; Chen, S.; Uzunidis, G.; Hähsler, M.; Träutlein, Y.; Behrens, S. (2021). Bimetallic Pd/Sn‐based Nanoparticles and their Catalytic Properties in the Semihydrogenation of Diphenylacetylene. ChemistryOpen, 10 (2), 296–304. doi:10.1002/open.202000298
Zengel, D.; Stehle, M.; Deutschmann, O.; Casapu, M.; Grunwaldt, J.-D. (2021). Impact of gas phase reactions and catalyst poisons on the NH₃-SCR activity of a V₂O₅-WO₃/TiO₂ catalyst at pre-turbine position. Applied catalysis / B, 288, Article no: 119991. doi:10.1016/j.apcatb.2021.119991
Naina, V. R.; Wang, S.; Sharapa, D. I.; Zimmermann, M.; Hähsler, M.; Niebl-Eibenstein, L.; Wang, J.; Wöll, C.; Wang, Y.; Singh, S. K.; Studt, F.; Behrens, S. (2021). Shape-Selective Synthesis of Intermetallic Pd₃Pb Nanocrystals and Enhanced Catalytic Properties in the Direct Synthesis of Hydrogen Peroxide. ACS catalysis, 11 (4), 2288–2301. doi:10.1021/acscatal.0c03561
Bakhshan, M.; Wörner, M.; Dadvand, A. (2021). Simulation of droplet impingement on a rigid square obstacle in a microchannel using multiphase lattice Boltzmann method. Computational Particle Mechanics, 95. doi:10.1007/s40571-020-00384-9
Karp, S. G.; Medina, J. D. C.; Letti, L. A. J.; Woiciechowski, A. L.; Carvalho, J. C. de; Schmitt, C. C.; Oliveira Penha, R. de; Kumlehn, G. S.; Soccol, C. R. (2021). Bioeconomy and biofuels: the case of sugarcane ethanol in Brazil. Biofuels, Bioproducts and Biorefining, 15 (3), 899–912. doi:10.1002/bbb.2195
Zengel, D.; Barth, S.; Casapu, M.; Grunwaldt, J.-D. (2021). The Impact of Pressure and Hydrocarbons on NOx Abatement over Cu- and Fe-Zeolites at Pre-Turbocharger Position. Catalysts, 11 (3), 336. doi:10.3390/catal11030336
Sprenger, P.; Stehle, M.; Gaur, A.; Weiß, J.; Brueckner, D.; Zhang, Y.; Garrevoet, J.; Suuronen, J.-P.; Thomann, M.; Fischer, A.; Grunwaldt, J.-D.; Sheppard, T. L. (2021). Chemical imaging of mixed metal oxide catalysts for propylene oxidation: from model binary systems to complex multicomponent systems. ChemCatChem, 13 (10), 2483–2493. doi:10.1002/cctc.202100054
Wörner, M.; Samkhaniani, N.; Cai, X.; Wu, Y.; Majumdar, A.; Marschall, H.; Frohnapfel, B.; Deutschmann, O. (2021). Spreading and rebound dynamics of sub-millimetre urea-water-solution droplets impinging on substrates of varying wettability. Applied mathematical modelling, 95, 53–73. doi:10.1016/j.apm.2021.01.038
Eggart, D.; Zimina, A.; Cavusoglu, G.; Casapu, M.; Doronkin, D. E.; Lomachenko, K. A.; Grunwaldt, J.-D. (2021). Versatile and high temperature spectroscopic cell for operando fluorescence and transmission x-ray absorption spectroscopic studies of heterogeneous catalysts. Review of scientific instruments, 92 (2), Art.-Nr. 023106. doi:10.1063/5.0038428
Wild, S.; Polierer, S.; Zevaco, T. A.; Guse, D.; Kind, M.; Pitter, S.; Delgado, K. H.; Sauer, J. (2021). Direct DME synthesis on CZZ/H-FER from variable CO
Goodman, E. D.; Carlson, E. Z.; Dietze, E. M.; Tahsini, N.; Johnson, A.; Aitbekova, A.; Nguyen Taylor, T.; Plessow, P. N.; Cargnello, M. (2021). Size-controlled nanocrystals reveal spatial dependence and severity of nanoparticle coalescence and Ostwald ripening in sintering phenomena. Nanoscale, 13 (2), 930–938. doi:10.1039/d0nr07960j
Dusold, C.; Sharapa, D. I.; Hampel, F.; Hirsch, A. (2021). π‐Extended Diaza[7]helicenes by Hybridization of Naphthalene Diimides and Hexa‐peri‐hexabenzocoronenes. Chemistry - a European journal, 27 (7), 2332–2341. doi:10.1002/chem.202003402
Deschner, B. J.; Doronkin, D. E.; Sheppard, T. L.; Zimina, A.; Grunwaldt, J.-D.; Dittmeyer, R. (2021). Effect of Selectivity Enhancers on the Structure of Palladium during High-Pressure Continuous-Flow Direct Synthesis of Hydrogen Peroxide in Ethanol. The journal of physical chemistry <Washington, DC> / C, 125 (6), 3451–3462. doi:10.1021/acs.jpcc.0c11246
Konnerth, P.; Jung, D.; Straten, J. W.; Raffelt, K.; Kruse, A. (2021). Metal oxide-doped activated carbons from bakery waste and coffee grounds for application in supercapacitors. Materials science for energy technologies, 4, 69–80. doi:10.1016/j.mset.2020.12.008
Amsler, J.; Plessow, P. N.; Studt, F. (2021). Effect of Impurities on the Initiation of the Methanol-to-Olefins Process: Kinetic Modeling Based on Ab Initio Rate Constants. Catalysis letters, 15 (9), 2595–2602. doi:10.1007/s10562-020-03492-6
Marquart, W.; Raseale, S.; Prieto, G.; Zimina, A.; Sarma, B. B.; Grunwaldt, J.-D.; Claeys, M.; Fischer, N. (2021). CO2 Reduction over Mo2C-Based Catalysts. ACS catalysis, 11, 1624–1639. doi:10.1021/acscatal.0c05019
Halim, R.; Papachristou, I.; Kubisch, C.; Nazarova, N.; Wüstner, R.; Steinbach, D.; Chen, G. Q.; Deng, H.; Frey, W.; Posten, C.; Silve, A. (2021). Hypotonic osmotic shock treatment to enhance lipid and protein recoveries from concentrated saltwater Nannochloropsis slurries. Fuel, 287, Art.-Nr.: 119442. doi:10.1016/j.fuel.2020.119442
Taghipour, A.; Hornung, U.; Ramirez, J. A.; Brown, R. J.; Rainey, T. J. (2021). Aqueous phase recycling in catalytic hydrothermal liquefaction for algal biomass and the effect on elemental accumulation and energy efficiency. Journal of cleaner production, 289, Article: 125582. doi:10.1016/j.jclepro.2020.125582
Becher, J.; Sanchez, D. F.; Doronkin, D. E.; Zengel, D.; Meira, D. M.; Pascarelli, S.; Grunwaldt, J.-D.; Sheppard, T. L. (2021). Chemical gradients in automotive Cu-SSZ-13 catalysts for NO
Awasthi, M. K.; Rai, R. K.; Behrens, S.; Singh, S. K. (2021). Low-temperature hydrogen production from methanol over a ruthenium catalyst in water. Catalysis science & technology, 11 (1), 136–142. doi:10.1039/d0cy01470b
Fan, Y.; Fonseca, F. G.; Gong, M.; Hoffmann, A.; Hornung, U.; Dahmen, N. (2021). Energy valorization of integrating lipid extraction and hydrothermal liquefaction of lipid-extracted sewage sludge. Journal of cleaner production, 285, Art.Nr. 124895. doi:10.1016/j.jclepro.2020.124895
Smith, A. T.; Plessow, P. N.; Studt, F. (2021). Density functional theory calculations of diffusion barriers of organic molecules through the 8-ring of H-SSZ-13. Chemical physics, 541, Art.-Nr.: 111033. doi:10.1016/j.chemphys.2020.111033
Woo, M.; Tischer, S.; Deutschmann, O.; Wörner, M. (2021). A step toward the numerical simulation of catalytic hydrogenation of nitrobenzene in Taylor flow at practical conditions. Chemical engineering science, 230, Art.-Nr.: 116132. doi:10.1016/j.ces.2020.116132
Kibis, L. S.; Svintsitskiy, D.; Stadnichenko, A. I.; Slavinskaya, E. M.; Romanenko, A.; Fedorova, E. A.; Stonkus, O. A.; Svetlichnyi, V.; Fakhrutdinova, E. D.; Vorokhta, M.; Šmíd, B.; Doronkin, D. E.; Marchuk, V.; Grunwaldt, J.-D.; Boronin, A. I. (2021). In situ probing of Pt/TiO
Straß-Eifert, A.; Sheppard, T. L.; Damsgaard, C. D.; Grunwaldt, J.-D.; Güttel, R. (2021). Stability of Cobalt Particles in and outside HZSM‐5 under CO Hydrogenation Conditions Studied by ex situ and in situ Electron Microscopy. ChemCatChem, 13 (2), 718–729. doi:10.1002/cctc.202001533
Schmitt, S.; Schwarz, S.; Ruwe, L.; Horstmann, J.; Sabath, F.; Maier, L.; Deutschmann, O.; Kohse-Höinghaus, K. (2021). Homogeneous conversion of NO
Wang, C.; Wu, C.; Hornung, U.; Zhu, W.; Dahmen, N. (2021). Suppression of tar and char formation in supercritical water gasification of sewage sludge by additive addition. Chemosphere, 262, Article: 128412. doi:10.1016/j.chemosphere.2020.128412
Boronin, A. I.; Slavinskaya, E.; Kibis, L.; Stonkus, O.; Svintsitskiy, D.; Stadnichenko, A.; Fedorova, E.; Romanenko, A.; Marchuk, V.; Doronkin, D. (2021). The effects of platinum dispersion and Pt state on catalytic properties of Pt/Al2O3 in NH3 oxidation. ChemCatChem, 13 (1), 313–327. doi:10.1002/cctc.202001320
Stökle, K.; Hülsemann, B.; Steinbach, D.; Cao, Z.; Oechsner, H.; Kruse, A. (2021). A biorefinery concept using forced chicory roots for the production of biogas, hydrochar, and platform chemicals. Biomass Conversion and Biorefinery, 11, 1453–1463. doi:10.1007/s13399-019-00527-w
2020
Journal Articles
Guse, D.; Polierer, S.; Wild, S.; Pitter, S.; Kind, M. (2020). Fundamental description of ageing in the manufacturing of copper‐zinc‐based catalysts by using a thermodynamic equilibrium model. Chemie Ingenieur Technik, 92 (9), 1357–1358. doi:10.1002/cite.202055240
Steiner, A.-K.; Sharapa, D. I.; Troyanov, S. I.; Nuss, J.; Amsharov, K. (2020). Carbon Origami via an Alumina-Assisted Cyclodehydrofluorination Strategy. Chemistry - A European Journal, 2021 (27), 1–8. doi:10.1002/chem.202003448
Heinz, W. R.; Agirrezabal-Telleria, I.; Junk, R.; Berger, J.; Wang, J.; Sharapa, D. I.; Gil-Calvo, M.; Luz, I.; Soukri, M.; Studt, F.; Wang, Y.; Wöll, C.; Bunzen, H.; Drees, M.; Fischer, R. A. (2020). Thermal Defect Engineering of Precious Group Metal–Organic Frameworks: A Case Study on Ru/Rh-HKUST-1 Analogues. ACS applied materials & interfaces, 12 (36), 40635–40647. doi:10.1021/acsami.0c10721
Perilli, D.; Di Valentin, C.; Studt, F. (2020). Can Single Metal Atoms Trapped in Defective h-BN/Cu(111) Improve Electrocatalysis of the H
Thrän, D.; Bauschmann, M.; Dahmen, N.; Erlach, B.; Heinbach, K.; Hirschl, B.; Hildebrand, J.; Rau, I.; Majer, S.; Oehmichen, K.; Schweizer-Ries, P.; Hennig, C. (2020). Bioenergy beyond the German “Energiewende”–Assessment framework for integrated bioenergy strategies. Biomass and bioenergy, 142, Art.-Nr.: 105769. doi:10.1016/j.biombioe.2020.105769
Steinbach, D.; Kruse, A.; Sauer, J.; Storz, J. (2020). Is Steam Explosion a Promising Pretreatment for Acid Hydrolysis of Lignocellulosic Biomass?. Processes, 8 (12), Art.-Nr.: 1626. doi:10.3390/pr8121626
Lustemberg, P. G.; Plessow, P. N.; Wang, Y.; Yang, C.; Nefedov, A.; Studt, F.; Wöll, C.; Ganduglia-Pirovano, M. V. (2020). Vibrational Frequencies of Cerium-Oxide-Bound CO: A Challenge for Conventional DFT Methods. Physical review letters, 125 (25), Art.-Nr.: 256101. doi:10.1103/PhysRevLett.125.256101
Doronkin, D. E.; Casapu, M.; Grunwaldt, J.-D. (2020). Applications of Hard X-ray Spectroscopy in Energy-Related and Environmental Catalysis. Synchrotron radiation news, 33 (5), 11–17. doi:10.1080/08940886.2020.1812353
Araujo-Lopez, E.; Vandegehuchte, B. D.; Curulla-Ferré, D.; Sharapa, D. I.; Studt, F. (2020). Trends in the Activation of Light Alkanes on Transition-Metal Surfaces. The journal of physical chemistry <Washington, DC> / C, 124 (50), 27503–27510. doi:10.1021/acs.jpcc.0c08076
Weber, S.; Abel, K. L.; Zimmermann, R. T.; Huang, X.; Bremer, J.; Rihko-Struckmann, L. K.; Batey, D.; Cipiccia, S.; Titus, J.; Poppitz, D.; Kübel, C.; Sundmacher, K.; Gläser, R.; Sheppard, T. L. (2020). Porosity and Structure of Hierarchically Porous Ni/Al₂O₃ Catalysts for CO₂ Methanation. Catalysts, 10 (12), Art. Nr.: 1471. doi:10.3390/catal10121471
Woo, M.; Maier, L.; Tischer, S.; Deutschmann, O.; Wörner, M. (2020). A Qualitative Numerical Study on Catalytic Hydrogenation of Nitrobenzene in Gas-Liquid Taylor Flow with Detailed Reaction Mechanism. Fluids, 5 (4), Art.-Nr.: 234. doi:10.3390/fluids5040234
Yu, J.; Yang, M.; Zhang, J.; Ge, Q.; Zimina, A.; Pruessmann, T.; Zheng, L.; Grunwaldt, J.-D.; Sun, J. (2020). Stabilizing Cu
Wodarz, S.; Slaby, N. A.; Zimmermann, M. C.; Otto, T. N.; Holzinger, J.; Skibsted, J.; Zevaco, T. A.; Pitter, S.; Sauer, J. (2020). Shaped Hierarchical H-ZSM-5 Catalysts for the Conversion of Dimethyl Ether to Gasoline. Industrial & engineering chemistry research, 59 (40), 17689–17707. doi:10.1021/acs.iecr.9b06256
Giehr, A.; Maier, L.; Angeli, S.; Schunk, S. A.; Deutschmann, O. (2020). Dry and Steam Reforming of CH
Dietrich, C.; Hähsler, M.; Wang, W.; Kübel, C.; Behrens, S. (2020). Designing Structurally Ordered Pt/Sn Nanoparticles in Ionic Liquids and their Enhanced Catalytic Performance. ChemNanoMat, 6 (12), 1854–1862. doi:10.1002/cnma.202000433
Woo, M.; Deutschmann, O.; Wörner, M. (2020). Influence of liquid composition on diffusive mass transfer in the lubricating film of Taylor flow—A study related to the hydrogenation of nitrobenzene. Chemical engineering and processing, 149, Art. Nr.: 107835. doi:10.1016/j.cep.2020.107835
Wan, S.; Guo, Y.; Häber, T.; Suntz, R.; Deutschmann, O. (2020). Spatially and Temporally Resolved Measurements of NO Adsorption/Desorption over NOx‐Storage Catalyst. ChemPhysChem, 21 (23), 2497–2501. doi:10.1002/cphc.202000765
Plessow, P. N.; Studt, F. (2020). Olefin methylation and cracking reactions in H-SSZ-13 investigated withab initioand DFT calculations (vol 8, pg 4420, 2018). Catalysis science & technology, 10 (19), 6738–6739. doi:10.1039/d0cy90088e
Weiss, C.; Sharapa, D. I.; Hirsch, A. (2020). Coronenohelicenes with Dynamic Chirality. Chemistry - a European journal, 26 (62), 14100–14108. doi:10.1002/chem.202001703
Infantes, A.; Kugel, M.; Raffelt, K.; Neumann, A. (2020). Side-by-Side Comparison of Clean and Biomass-Derived, Impurity-Containing Syngas as Substrate for Acetogenic Fermentation with Clostridium ljungdahlii. Fermentation, 6 (3), Article: 84. doi:10.3390/fermentation6030084
Feofanov, M.; Akhmetov, V.; Sharapa, D. I.; Amsharov, K. (2020). Modular Approach to the Synthesis of Two-Dimensional Angular Fused Acenes. Organic letters, 22 (5), 1698–1702. doi:10.1021/acs.orglett.9b04382
Bulsink, P.; Mercader, M. F. D.; Sandström, L.; Van de Beld, B.; Preto, F.; Zacher, A.; Oasmaa, A.; Dahmen, N.; Funke, A.; Bronson, B. (2020). Results of the International Energy Agency Bioenergy Round Robin on the Analysis of Heteroatoms in Biomass Liquefaction Oils. Energy & fuels, 34 (9), 11123–11133. doi:10.1021/acs.energyfuels.0c02090
Alhnidi, M.-J.; Wüst, D.; Funke, A.; Hang, L.; Kruse, A. (2020). Fate of Nitrogen, Phosphate, and Potassium during Hydrothermal Carbonization and the Potential for Nutrient Recovery. ACS sustainable chemistry & engineering, 8 (41), 15507–15516. doi:10.1021/acssuschemeng.0c04229
Karadeniz, H.; Karakaya, C.; Tischer, S.; Deutschmann, O. (2020). Numerical Simulation of Methane and Propane Reforming Over a Porous Rh/Al
Feofanov, M.; Akhmetov, V.; Sharapa, D. I.; Amsharov, K. (2020). Oxidative Electrocyclization of Diradicaloids: C–C Bonds for Free or How to Use Biradical Character for π-Extension. Organic letters, 22 (15), 5741–5745. doi:10.1021/acs.orglett.0c01717
Fečík, M.; Plessow, P. N.; Studt, F. (2020). A Systematic Study of Methylation from Benzene to Hexamethylbenzene in H-SSZ-13 Using Density Functional Theory and Ab Initio Calculations. ACS catalysis, 10 (15), 8916–8925. doi:10.1021/acscatal.0c02037
Zakutanská, K.; Feoktystov, A.; Lacková, V.; Tomašovičová, N.; Appel, I.; Behrens, S.; Kopčanský, P. (2020). SANS Study of Liquid Crystal Doped with CoFe
Serrer, M.-A.; Gaur, A.; Jelic, J.; Weber, S.; Fritsch, C.; Clark, A. H.; Saraçi, E.; Studt, F.; Grunwaldt, J.-D. (2020). Structural dynamics in Ni–Fe catalysts during CO₂ methanation - role of iron oxide clusters. Catalysis science & technology, 10 (22), 7542–7554. doi:10.1039/D0CY01396J
Haltenort, P.; Lösch, O.; Schäfer, B.; Sauer, J. (2020). Energieeffizienz in der Prozessindustrie – Technologieoptionen des Forschungsnetzwerks Energie in Industrie und Gewerbe. Chemie - Ingenieur - Technik, 92 (9), 1268. doi:10.1002/cite.202055180
Schade, O.; Stein, F.; Reichenberger, S.; Gaur, A.; Saraci, E.; Barcikowski, S.; Grunwaldt, J.-D. (2020). Selective aerobic oxidation of 5‐(hydroxymethyl)furfural over heterogeneous silver‐gold nanoparticle catalysts. Advanced synthesis & catalysis, 362 (24), 5681–5696. doi:10.1002/adsc.202001003
Sarma, B. B.; Plessow, P. N.; Agostini, G.; Concepción, P.; Pfänder, N.; Kang, L.; Wang, F. R.; Studt, F.; Prieto, G. (2020). Metal-Specific Reactivity in Single-Atom Catalysts: CO Oxidation on 4d and 5d Transition Metals Atomically Dispersed on MgO. Journal of the American Chemical Society, 142 (35), 14890–14902. doi:10.1021/jacs.0c03627
Maurer, F.; Jelic, J.; Wang, J.; Gänzler, A.; Dolcet, P.; Wöll, C.; Wang, Y.; Studt, F.; Casapu, M.; Grunwaldt, J.-D. (2020). Tracking the formation, fate and consequence for catalytic activity of Pt single sites on CeO2. Nature catalysis, 3, 824–833. doi:10.1038/s41929-020-00508-7
Casapu, M.; Zheng, L.; Zimina, A.; Grunwaldt, J.-D. (2020). Hydrocarbon and soot oxidation over cerium and iron doped vanadium SCR catalysts. ChemCatChem, 12 (24), 6272–6284. doi:10.1002/cctc.202001314
Keller, K.; Lott, P.; Stotz, H.; Maier, L.; Deutschmann, O. (2020). Microkinetic Modeling of the Oxidation of Methane Over PdO Catalysts—Towards a Better Understanding of the Water Inhibition Effect. Catalysts, 10 (8), Art.-Nr.: 922. doi:10.3390/catal10080922
Arvidsson, A. A.; Plessow, P. N.; Studt, F.; Hellman, A. (2020). Influence of Acidity on the Methanol-to-DME Reaction in Zeotypes: A First Principles-Based Microkinetic Study. The journal of physical chemistry <Washington, DC> / C, 124 (27), 14658–14663. doi:10.1021/acs.jpcc.0c03125
Han, S.; Zhao, D.; Lund, H.; Rockstroh, N.; Bartling, S.; Doronkin, D. E.; Grunwaldt, J.-D.; Gao, M.; Jiang, G.; Kondratenko, E. V. (2020). TiO
Zhan, X.; Yan, C.; Zhang, Y.; Rinke, G.; Rabsch, G.; Klumpp, M.; Schäfer, A. I.; Dittmeyer, R. (2020). Investigation of the reaction kinetics of photocatalytic pollutant degradation under defined conditions with inkjet-printed TiO
Schropp, A.; Döhrmann, R.; Botta, S.; Brückner, D.; Kahnt, M.; Lyubomirskiy, M.; Ossig, C.; Scholz, M.; Seyrich, M.; Stuckelberger, M. E.; Wiljes, P.; Wittwer, F.; Garrevoet, J.; Falkenberg, G.; Fam, Y.; Sheppard, T. L.; Grunwaldt, J.-D.; Schroer, C. G. (2020). PtyNAMi: ptychographic nano-analytical microscope. Journal of applied crystallography, 53 (4), 957–971. doi:10.1107/S1600576720008420
Plessow, P. N. (2020). The transformation of cuboctahedral to icosahedral nanoparticles: atomic structure and dynamics. Physical chemistry, chemical physics, 22 (23), 12939–12945. doi:10.1039/d0cp01651a
Lappalainen, J.; Baudouin, D.; Hornung, U.; Schuler, J.; Melin, K.; Bjelić, S.; Vogel, F.; Konttinen, J.; Joronen, T. (2020). Sub- and Supercritical Water Liquefaction of Kraft Lignin and Black Liquor Derived Lignin. Energies, 13 (13), Article: 3309. doi:10.3390/en13133309
Polierer, S.; Guse, D.; Wild, S.; Herrera Delgado, K.; Otto, T. N.; Zevaco, T. A.; Kind, M.; Sauer, J.; Studt, F.; Pitter, S. (2020). Enhanced Direct Dimethyl Ether Synthesis from CO
Han, S.; Zhao, D.; Otroshchenko, T.; Lund, H.; Bentrup, U.; Kondratenko, V. A.; Rockstroh, N.; Bartling, S.; Doronkin, D. E.; Grunwaldt, J.-D.; Rodemerck, U.; Linke, D.; Gao, M.; Jiang, G.; Kondratenko, E. V. (2020). Elucidating the Nature of Active Sites and Fundamentals for their Creation in Zn-Containing ZrO2-Based Catalysts for Non-Oxidative Propane Dehydrogenation. ACS catalysis, 10 (15), 8933–8949. doi:10.1021/acscatal.0c01580
Stadnichenko, A.; Svintsitskiy, D.; Kibis, L.; Fedorova, E.; Stonkus, O.; Slavinskaya, E.; Lapin, I.; Fakhrutdinova, E.; Svetlichnyi, V.; Romanenko, A.; Doronkin, D.; Marchuk, V.; Grunwaldt, J.-D.; Boronin, A. (2020). Influence of Titania Synthesized by Pulsed Laser Ablation on the State of Platinum during Ammonia Oxidation. Applied Sciences, 10 (14), Art. Nr.: 4699. doi:10.3390/app10144699
Naim, W.; Schade, O. R.; Saraci, E.; Wüst, D.; Kruse, A.; Grunwaldt, J.-D. (2020). Towards an intensified process of biomass-derived monomers: The influence of HMF by-products on gold-catalyzed synthesis of 2,5-furandicarboxylic acid. ACS sustainable chemistry & engineering, 8 (31), 11512–11521. doi:10.1021/acssuschemeng.0c01319
Müller, S.; Zimina, A.; Steininger, R.; Flessau, S.; Osswald, J.; Grunwaldt, J.-D. (2020). High stability of Rh oxide-based thermoresistive catalytic combustion sensors proven by operando XAS and XRD. ACS sensors, 5 (8), 2486–2496. doi:10.1021/acssensors.0c00712
Rai, R. K.; Awasthi, M. K.; Singh, V. K.; Barman, S. R.; Behrens, S.; Singh, S. K. (2020). Aqueous Phase Semihydrogenation of Alkynes over Ni-Fe Bimetallic Catalysts. Catalysis science & technology, 10 (15), 4968–4980. doi:10.1039/D0CY01153C
Delgado Otalvaro, N.; Kaiser, M.; Herrera Delgado, K.; Wild, S.; Sauer, J.; Freund, H. (2020). Optimization of the direct synthesis of dimethyl ether from CO₂ rich synthesis gas: Closing the loop between experimental investigations and model-based reactor design. Reaction chemistry & engineering, 5 (5), 949–960. doi:10.1039/d0re00041h
Steinbach, D.; Klier, A.; Kruse, A.; Sauer, J.; Wild, S.; Zanker, M. (2020). Isomerization of Glucose to Fructose in Hydrolysates from Lignocellulosic Biomass Using Hydrotalcite. Processes, 8 (6), Article: 644. doi:10.3390/PR8060644
Liu, C.-Y.; Struwe, K.; Lee, C.-H.; Chuang, H.-Y.; Sauer, J.; Yu, J. C.-C.; Nguyen, V.-H.; Huang, C.-W.; Wu, J. C. S. (2020). Ethanol conversion to selective high-value hydrocarbons over Ni/HZSM-5 zeolite catalyst. Catalysis communications, 144, 106067. doi:10.1016/j.catcom.2020.106067
Schade, O. R.; Gaur, A.; Zimina, A.; Saraci, E.; Grunwaldt, J.-D. (2020). Mechanistic Insights into the Selective Oxidation of 5-(Hydroxymethyl)furfural over Silver-based Catalysts. Catalysis science & technology, 10 (15), 5036–5047. doi:10.1039/D0CY00878H
Doronkin, D. E.; Wang, S.; Sharapa, D.; Deschner, B. J.; Sheppard, T. L.; Zimina, A.; Studt, F.; Dittmeyer, R.; Behrens, S.; Grunwaldt, J.-D. (2020). Dynamic structural changes of supported Pd, PdSn, and PdIn nanoparticles during continuous flow high pressure direct H
Lott, P.; Eck, M.; Doronkin, D. E.; Zimina, A.; Tischer, S.; Popescu, R.; Belin, S.; Briois, V.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2020). Understanding Sulfur Poisoning of Bimetallic Pd-Pt Methane Oxidation Catalysts and their Regeneration. Applied catalysis / B, 278, Art.Nr.: 119244. doi:10.1016/j.apcatb.2020.119244
Zimmermann, R.; Siebert, M.; Ibrahimkutty, S.; Dittmeyer, R.; Armbrüster, M. (2020). Intermetallic GaPd
Plessow, P. N.; Studt, F. (2020). How Accurately Do Approximate Density Functionals Predict Trends in Acidic Zeolite Catalysis?. The journal of physical chemistry letters, 11 (11), 4305–4310. doi:10.1021/acs.jpclett.0c01240
Amsler, J.; Sarma, B. B.; Agostini, G.; Prieto, G.; Plessow, P. N.; Studt, F. (2020). Prospects of Heterogeneous Hydroformylation with Supported Single Atom Catalysts. Journal of the American Chemical Society, 142 (11), 5087–5096. doi:10.1021/jacs.9b12171
Anca-Couce, A.; Tsekos, C.; Retschitzegger, S.; Zimbardi, F.; Funke, A.; Banks, S.; Kraia, T.; Marques, P.; Scharler, R.; Jong, W. de; Kienzl, N. (2020). Biomass pyrolysis TGA assessment with an international round robin. Fuel, 276, Art. Nr.: 118002. doi:10.1016/j.fuel.2020.118002
Michler, T.; Wippermann, N.; Toedter, O.; Niethammer, B.; Otto, T.; Arnold, U.; Pitter, S.; Koch, T.; Sauer, J. (2020). Gasoline from the bioliq® process: Production, characterization and performance. Fuel processing technology, 206, Article no: 106476. doi:10.1016/j.fuproc.2020.106476
Świątek, K.; Gaag, S.; Klier, A.; Kruse, A.; Sauer, J.; Steinbach, D. (2020). Acid hydrolysis of lignocellulosic biomass: Sugars and furfurals formation. Catalysts, 10 (4), Article no: 437. doi:10.3390/catal10040437
Gaur, A.; Stehle, M.; Raun, K. V.; Thrane, J.; Jensen, A. D.; Grunwaldt, J.-D.; Høj, M. (2020). Structural dynamics of an iron molybdate catalyst under redox cycling conditions studied with in situ multi edge XAS and XRD. Physical chemistry, chemical physics, 22 (20), 11713–11723. doi:10.1039/D0CP01506G
Frei, E.; Gaur, A.; Lichtenberg, H.; Zwiener, L.; Scherzer, M.; Girgsdies, F.; Lunkenbein, T.; Schlögl, R. (2020). Cu‐Zn alloy formation as unfavored state for efficient methanol catalysts. ChemCatChem, 12 (16), 4029–4033. doi:10.1002/cctc.202000777
Zengel, D.; Koch, P.; Torkashvand, B.; Grunwaldt, J.-D.; Casapu, M.; Deutschmann, O. (2020). Freisetzung von toxischem HCN bei der Stickoxidreduktion mittels NH₃‐SCR in mager betriebenen Erdgasmotoren. Angewandte Chemie, 132 (34), 14530–14535. doi:10.1002/ange.202003670
Klemm, E.; Sauer, J. (2020). Reaktionstechnik in Corona‐Zeiten = Reaction Technics in Corona Times. Chemie - Ingenieur - Technik, 92 (5), 491. doi:10.1002/cite.202070502
Antritter, T.; Mayer, M.; Hachmann, P.; Wörner, M. (2020). Suppressing artificial equilibrium states caused by spurious currents in droplet spreading simulations with dynamic contact angle model. Progress in computational fluid dynamics, 20 (2), 59–70. doi:10.1504/PCFD.2020.106403
Wörner, M. (2020). A Correlation for the Characteristic Velocity Ratio to Predict Hydrodynamics of Capillary Gas–Liquid Taylor Flow. Theoretical foundations of chemical engineering, 54 (1), 3–16. doi:10.1134/S0040579520010236
Wang, W.; Sharapa, D. I.; Chandresh, A.; Nefedov, A.; Heißler, S.; Heinke, L.; Studt, F.; Wang, Y.; Wöll, C. (2020). Interplay of Electronic and Steric Effects to Yield Low‐Temperature CO Oxidation at Metal Single Sites in Defect‐Engineered HKUST‐1. Angewandte Chemie / International edition, 59 (26), 10514–10518. doi:10.1002/anie.202000385
Nielsen, M. R.; Moss, A. B.; Bjørnlund, A. S.; Liu, X.; Knop-Gericke, A.; Klyushin, A. Y.; Grunwaldt, J.-D.; Sheppard, T. L.; Doronkin, D. E.; Zimina, A.; Smitshuysen, T. E. L.; Damsgaard, C. D.; Wagner, J. B.; Hansen, T. W. (2020). Reduction and carburization of iron oxides for Fischer-Tropsch synthesis. Journal of Energy Chemistry, 51, 48–61. doi:10.1016/j.jechem.2020.03.026
Hähsler, M.; Landers, J.; Nowack, T.; Salamon, S.; Zimmermann, M.; Heißler, S.; Wende, H.; Behrens, S. (2020). Magnetic Properties and Mössbauer Spectroscopy of Fe3O4/CoFe2O4 Nanorods. Inorganic chemistry, 59 (6), 3677–3685. doi:10.1021/acs.inorgchem.9b03267
Chou, C. W.; Collopy, A. L.; Kurz, C.; Lin, Y.; Harding, M. E.; Plessow, P. N.; Fortier, T.; Diddams, S.; Leibfried, D.; Leibrandt, D. R. (2020). Frequency-comb spectroscopy on pure quantum states of a single molecular ion. Science, 367 (6485), 1458–1461. doi:10.1126/science.aba3628
Loewert, M.; Serrer, M.-A.; Carambia, T.; Stehle, M.; Zimina, A.; Kalz, K.; Lichtenberg, H.; Saraci, E.; Pfeifer, P.; Grunwaldt, J.-D. (2020). Bridging the gap between industry and synchrotron: Operando study at 30 bar over 300 h during Fischer-Tropsch synthesis. Reaction chemistry & engineering, 5 (6), 1071–1082. doi:10.1039/C9RE00493A
Araujo-Lopez, E.; Joos, L.; Vandegehuchte, B. D.; Sharapa, D. I.; Studt, F. (2020). Theoretical Investigations of (Oxidative) Dehydrogenation of Propane to Propylene over Palladium Surfaces. The journal of physical chemistry <Washington, DC> / C, 124 (5), 3171–3176. doi:10.1021/acs.jpcc.9b11424
Wang, S.; Doronkin, D. E.; Hähsler, M.; Huang, X.; Wang, D.; Grunwaldt, J.-D.; Behrens, S. (2020). Palladium-Based Bimetallic Nanocrystal Catalysts for the Direct Synthesis of Hydrogen Peroxide. ChemSusChem, 13 (12), 3243–3251. doi:10.1002/cssc.202000407
Schade, O.; Dolcet, P.; Nefedov, A.; Huang, X.; Saraçi, E.; Wöll, C.; Grunwaldt, J.-D. (2020). The Influence of the Gold Particle Size on the Catalytic Oxidation of 5-(Hydroxymethyl)furfural. Catalysts, 10 (3), Article: 342. doi:10.3390/catal10030342
Smitshuysen, T. E. L.; Nielsen, M. R.; Pruessmann, T.; Zimina, A.; Sheppard, T. L.; Grunwaldt, J.-D.; Chorkendorff, I.; Damsgaard, C. D. (2020). Optimizing Ni-Fe-Ga alloys into Ni
Neves, R. C.; Klein, B. C.; Silva, R. J. da; Rezende, M. C. A. F.; Funke, A.; Olivarez-Gómez, E.; Bonomi, A.; Maciel-Filho, R. (2020). A vision on biomass-to-liquids (BTL) thermochemical routes in integrated sugarcane biorefineries for biojet fuel production. Renewable & sustainable energy reviews, 119, Art.-Nr. 109607. doi:10.1016/j.rser.2019.109607
Fan, Y.; Hornung, U.; Raffelt, K.; Dahmen, N. (2020). The influence of lipids on the fate of nitrogen during hydrothermal liquefaction of protein-containing biomass. Journal of analytical and applied pyrolysis, 147, Art. Nr.: 104798. doi:10.1016/j.jaap.2020.104798
Wang, S.; Lewis, R. J.; Doronkin, D. E.; Morgan, D. J.; Grunwaldt, J.-D.; Hutchings, G. J.; Behrens, S. (2020). The direct synthesis of hydrogen peroxide from H₂ and O₂ using Pd–Ga and Pd–In catalysts. Catalysis science & technology, 10 (6), 1925–1932. doi:10.1039/C9CY02210D
Yang, X.; Kahnt, M.; Brückner, D.; Schropp, A.; Fam, Y.; Becher, J.; Grunwaldt, J.-D.; Sheppard, T. L.; Schroer, C. G. (2020). Tomographic reconstruction with a generative adversarial network. Journal of synchrotron radiation, 27 (2), 486–493. doi:10.1107/S1600577520000831
Schäfer, B.; Sauer, J. (2020). Trends der chemischen Prozessindustrie. Chemie - Ingenieur - Technik, 92 (3), 183–191. doi:10.1002/cite.201900178
Dörnhöfer, J.; Börnhorst, M.; Ates, C.; Samkhaniani, N.; Pfeil, J.; Wörner, M.; Koch, R.; Bauer, H.-J.; Deutschmann, O.; Frohnapfel, B.; Koch, T. (2020). A Holistic View on Urea Injection for NOx Emission Control: Impingement, Re-atomization, and Deposit Formation. Emission control science and technology, 6, 228–243. doi:10.1007/s40825-019-00151-0
Sarma, B. B.; Kim, J.; Amsler, J.; Agostini, G.; Weidenthaler, C.; Pfänder, N.; Arenal, R.; Concepción, P.; Plessow, P.; Studt, F.; Prieto, G. (2020). One-Pot Cooperation of Single-Atom Rh and Ru Solid Catalysts for a Selective Tandem Olefin Isomerization-Hydrosilylation Process. Angewandte Chemie / International edition, 59 (14), 5806–5815. doi:10.1002/anie.201915255
Stoll, I. K.; Boukis, N.; Sauer, J. (2020). Syngas Fermentation to Alcohols: Reactor Technology and Application Perspective. Chemie - Ingenieur - Technik, 92 (1-2), 125–136. doi:10.1002/cite.201900118
Li, Z.; Song, C.; Li, J.; Liang, G.; Rao, L.; Yu, S.; Ding, X.; Tang, Y.; Yu, B.; Ou, J.; Lemmer, U.; Gomard, G. (2020). Highly Efficient and Water-Stable Lead Halide Perovskite Quantum Dots Using Superhydrophobic Aerogel Inorganic Matrix for White Light-Emitting Diodes. Advanced materials technologies, 5 (2), Article: 1900941. doi:10.1002/admt.201900941
Hähsler, M.; Zimmermann, M.; Heißler, S.; Behrens, S. (2020). Sc-doped barium hexaferrite nanodiscs: Tuning morphology and magnetic properties. Journal of magnetism and magnetic materials, 500, Article No.166349. doi:10.1016/j.jmmm.2019.166349
Wan, S.; Torkashvand, B.; Häber, T.; Suntz, R.; Deutschmann, O. (2020). Investigation of HCHO Catalytic Oxidation over Platinum using Planar Laser-Induced Fluorescence. Applied catalysis / B, 264, Article: 118473. doi:10.1016/j.apcatb.2019.118473
Zhao, Z.; Doronkin, D. E.; Ye, Y.; Grunwaldt, J.-D.; Huang, Z.; Zhou, Y. (2020). Visible light-enhanced photothermal CO2 hydrogenation over Pt/Al2O3 catalyst. Chinese journal of catalysis, 41 (2), 286–293. doi:10.1016/S1872-2067(19)63445-5
Amsharov, K.; Sharapa, D. I.; Vasilyev, O. A.; Oliver, M.; Hauke, F.; Goerling, A.; Soni, H.; Hirsch, A. (2020). Fractal-seaweeds type functionalization of graphene. Carbon, 158, 435–448. doi:10.1016/j.carbon.2019.11.008
Börnhorst, M.; Kuntz, C.; Tischer, S.; Deutschmann, O. (2020). Urea derived deposits in diesel exhaust gas after-treatment: Integration of urea decomposition kinetics into a CFD simulation. Chemical engineering science, 211, Article No.115319. doi:10.1016/j.ces.2019.115319
Sirisomboon, P.; Funke, A.; Posom, J. (2020). Improvement of proximate data and calorific value assessment of bamboo through near infrared wood chips acquisition. Renewable energy, 147, 1921–1931. doi:10.1016/j.renene.2019.09.128
Wang, C.; Fan, Y.; Hornung, U.; Zhu, W.; Dahmen, N. (2020). Char and tar formation during hydrothermal treatment of sewage sludge in subcritical and supercritical water: Effect of organic matter composition and experiments with model compounds. Journal of cleaner production, 242, 118586. doi:10.1016/j.jclepro.2019.118586
Schmitt, C. C.; Moreira, R.; Neves, R. C.; Richter, D.; Funke, A.; Raffelt, K.; Grunwaldt, J.-D.; Dahmen, N. (2020). From agriculture residue to upgraded product: The thermochemical conversion of sugarcane bagasse for fuel and chemical products. Fuel processing technology, 197, Article: 106199. doi:10.1016/j.fuproc.2019.106199
2019
Book Chapters
Arnold, U.; Haltenort, P.; Herrera Delgado, K.; Niethammer, B.; Sauer, J. (2019). Die Rolle von Dimethylether (DME) als Schlüsselbaustein synthetischer Kraftstoffe aus erneuerbaren Rohstoffen. Zukünftige Kraftstoffe : Energiewende des Transports als ein weltweites Klimaziel. Hrsg.: W. Maus, 532–561, Vieweg Verlag. doi:10.1007/978-3-662-58006-6_22
Journal Articles
Schade, O. R.; Dannecker, P.-K.; Kalz, K. F.; Steinbach, D.; Meier, M. A. R.; Grunwaldt, J.-D. (2019). Direct Catalytic Route to Biomass-Derived 2,5-Furandicarboxylic Acid and Its Use as Monomer in a Multicomponent Polymerization. ACS omega, 4 (16), 16972–16979. doi:10.1021/acsomega.9bo2373
Koch, T.; Sauer, J.; Toedter, O.; Hirth, T. (2019). reFuels - Notwendigkeit und Herausforderungen. Automobiltechnische Zeitschrift, 24 (S 2), 28–31.
Zhao, Z.-J.; Liu, S.; Zha, S.; Cheng, D.; Studt, F.; Henkelman, G.; Gong, J. (2019). Theory-guided design of catalytic materials using scaling relationships and reactivity descriptors. Nature reviews, 4 (12), 792–804. doi:10.1038/s41578-019-0152-x
Hähsler, M.; Behrens, S. (2019). Dendritic Ligands for Magnetic Suspensions in Liquid Crystals. European journal of organic chemistry, 2019 (48), 7820–7830. doi:10.1002/ejoc.201901450
Gänzler, A. M.; Casapu, M.; Doronkin, D. E.; Maurer, F.; Lott, P.; Glatzel, P.; Votsmeier, M.; Deutschmann, O.; Grunwaldt, J.-D. (2019). Unravelling the Different Reaction Pathways for Low Temperature CO Oxidation on Pt/CeO2 and Pt/Al2O3 by Spatially Resolved Structure–Activity Correlations. The journal of physical chemistry letters, 10 (24), 7698–7705. doi:10.1021/acs.jpclett.9b02768
Svintsitskiy, D. A.; Kibis, L. S.; Stadnichenko, A. I.; Slavinskaya, E. M.; Romanenko, A. V.; Fedorova, E. A.; Stonkus, O. A.; Doronkin, D. E.; Marchuk, V.; Zimina, A.; Casapu, M.; Grunwaldt, J.-D.; Boronin, A. I. (2019). Insight into the Nature of Active Species of Pt/Al2O3 Catalysts for low Temperature NH3 Oxidation. ChemCatChem, cctc.201901719. doi:10.1002/cctc.201901719
Sharapa, D. I.; Genaev, A.; Cavallo, L.; Minenkov, Y. (2019). A Robust and Cost‐Efficient Scheme for Accurate Conformational Energies of Organic Molecules. ChemPhysChem, 20 (1), 92–102. doi:10.1002/cphc.201801063
Zimmermann, M. C.; Otto, T. N.; Wodarz, S.; Zevaco, T. A.; Pitter, S. (2019). Mesoporous H‐ZSM‐5 for the Conversion of Dimethyl Ether to Hydrocarbons. Chemie - Ingenieur - Technik, 91 (9), 1302–1313. doi:10.1002/cite.201800217
Börnhorst, M.; Cai, X.; Wörner, M.; Deutschmann, O. (2019). Maximum Spreading of Urea Water Solution during Drop Impingement. Chemical engineering & technology, 42 (11), 2419–2427. doi:10.1002/ceat.201800755
Blondal, K.; Jelic, J.; Mazeau, E.; Studt, F.; West, R. H.; Goldsmith, F. C. (2019). Computer-Generated Kinetics for Coupled Heterogeneous/Homogeneous Systems: A Case Study in Catalytic Combustion of Methane on Platinum. Industrial & engineering chemistry, 58 (38), 17682–17691. doi:10.1021/acs.iecr.9b01464
Polierer, S.; Jelic, J.; Pitter, S.; Studt, F. (2019). On the Reactivity of the Cu/ZrO₂ System for the Hydrogenation of CO₂ to Methanol: A Density Functional Theory Study. The journal of physical chemistry <Washington, DC> / C, 123 (44), 26904–26911. doi:10.1021/acs.jpcc.9b06500
Kulsha, A. V.; Sharapa, D. I. (2019). Superhalogen and Superacid. Journal of computational chemistry, 40 (26), 2293–2300. doi:10.1002/jcc.26007
Gentzen, M.; Doronkin, D. E.; Sheppard, T. L.; Zimina, A.; Li, H.; Jelic, J.; Studt, F.; Grunwaldt, J.-D.; Sauer, J.; Behrens, S. (2019). Supported Intermetallic PdZn Nanoparticles as Bifunctional Catalysts for the Direct Synthesis of Dimethyl Ether from CO‐Rich Synthesis Gas. Angewandte Chemie, 131 (44), 15802–15806. doi:10.1002/ange.201906256
Weissenberger, T.; Leonhardt, R.; Zubiri, B. A.; Pitínová-Štekrová, M.; Sheppard, T. L.; Reiprich, B.; Bauer, J.; Dotzel, R.; Kahnt, M.; Schropp, A.; Schroer, C. G.; Grunwaldt, J.-D.; Casci, J. L.; Čejka, J.; Spiecker, E.; Schwieger, W. (2019). Synthesis and Characterisation of Hierarchically Structured Titanium Silicalite-1 Zeolites with Large Intracrystalline Macropores. Chemistry - a European journal, 25 (63), 14430–14440. doi:10.1002/chem.201903287
Kahnt, M.; Becher, J.; Brückner, D.; Fam, Y.; Sheppard, T.; Weissenberger, T.; Wittwer, F.; Grunwaldt, J.-D.; Schwieger, W.; Schroer, C. G. (2019). Coupled ptychography and tomography algorithm improves reconstruction of experimental data. Optica, 6 (10), 1282–1289. doi:10.1364/OPTICA.6.001282
Becher, J.; Sheppard, T. L.; Fam, Y.; Baier, S.; Wang, W.; Wang, D.; Kulkarni, S.; Keller, T. F.; Lyubomirskiy, M.; Brueckner, D.; Kahnt, M.; Schropp, A.; Schroer, C. G.; Grunwaldt, J.-D. (2019). Mapping the Pore Architecture of Structured Catalyst Monoliths from Nanometer to Centimeter Scale with Electron and X-ray Tomographies. The journal of physical chemistry <Washington, DC> / C, 123 (41), 25197–25208. doi:10.1021/acs.jpcc.9b06541
Sauer, J.; Klemm, E. (2019). Beitrag der chemischen Reaktionstechnik zur Energiewende. Chemie - Ingenieur - Technik, 91 (5), 543. doi:10.1002/cite.201970052
Dietze, E. M.; Pleßow, P. N.; Studt, F. (2019). Modeling the Size Dependency of the Stability of Metal Nanoparticles. The journal of physical chemistry <Washington, DC> / C, 123 (41), 25464–25469. doi:10.1021/acs.jpcc.9b06952
Dietze, E. M.; Pleßow, P. N. (2019). Predicting the Strength of Metal–Support Interaction with Computational Descriptors for Adhesion Energies. The journal of physical chemistry <Washington, DC> / C, 123 (33), 20443–20450. doi:10.1021/acs.jpcc.9b06893
Fam, Y.; Sheppard, T. L.; Becher, J.; Scherhaufer, D.; Lambach, H.; Kulkarni, S.; Keller, T. F.; Wittstock, A.; Wittwer, F.; Seyrich, M.; Brueckner, D.; Kahnt, M.; Yang, X.; Schropp, A.; Stierle, A.; Schroer, C. G.; Grunwaldt, J.-D. (2019). A versatile nanoreactor for complementary in situ X-ray and electron microscopy studies in catalysis and materials science. Journal of synchrotron radiation, 26 (5), 1769–1781. doi:10.1107/S160057751900660X
Serrer, M.-A.; Kalz, K. F.; Saraҫi E.; Lichtenberg, H.; Grunwaldt, J.-D. (2019). Role of Iron on the Structure and Stability of Ni3.2Fe/Al2O3 during Dynamic CO2 Methanation for P2X Applications. ChemCatChem, 11 (20), 5018–5021. doi:10.1002/cctc.201901425
Horlamus, F.; Wang, Y.; Steinbach, D.; Vahidinasab, M.; Wittgens, A.; Rosenau, F.; Henkel, M.; Hausmann, R. (2019). Potential of biotechnological conversion of lignocellulose hydrolyzates by Pseudomonas putida KT2440 as a model organism for a bio‐based economy. Global change biology / Bioenergy, 11 (12), 1421–1434. doi:10.1111/gcbb.12647
Gentzen, M.; Doronkin, D. E.; Sheppard, T. L.; Zimina, A.; Li, H.; Jelic, J.; Studt, F.; Grunwaldt, J.-D.; Sauer, J.; Behrens, S. (2019). Supported Intermetallic PdZn Nanoparticles as Bifunctional Catalysts for the Direct Synthesis of Dimethyl Ether from CO-Rich Synthesis Gas. Angewandte Chemie / International edition, 58 (44), 15655–15659. doi:10.1002/anie.201906256
Schade, O. R.; Dannecker, P.-K.; Kalz, K. F.; Steinbach, D.; Meier, M. A. R.; Grunwaldt, J.-D. (2019). Direct Catalytic Route to Biomass-Derived 2,5-Furandicarboxylic Acid and Its Use as Monomer in a Multicomponent Polymerization. ACS omega, 4 (16), 16972–16979. doi:10.1021/acsomega.9b02373
Steinbach, D.; Wüst, D.; Zielonka, S.; Krümpel, J.; Munder, S.; Pagel, M.; Kruse, A. (2019). Steam Explosion Conditions Highly Influence the Biogas Yield of Rice Straw. Molecules, 24 (19), Article: 3492. doi:10.3390/molecules24193492
Carriel Schmitt, C.; Zimina, A.; Fam, Y.; Raffelt, K.; Grunwaldt, J.-D.; Dahmen, N. (2019). Evaluation of High-Loaded Ni-Based Catalysts for Upgrading Fast Pyrolysis Bio-Oil. Catalysts, 9 (9), Article: 784. doi:10.3390/catal9090784
Guo, B.; Yang, B.; Silve, A.; Akaberi, S.; Scherer, D.; Papachristou, I.; Frey, W.; Hornung, U.; Dahmen, N. (2019). Hydrothermal liquefaction of residual microalgae biomass after pulsed electric field-assisted valuables extraction. Algal Research, 43, 101650. doi:10.1016/j.algal.2019.101650
Gaur, A.; Schumann, M.; Raun, K. V.; Stehle, M.; Beato, P.; Jensen, A. D.; Grunwaldt, J.-D.; Høj, M. (2019). Operando XAS/XRD and Raman Spectroscopic Study of Structural Changes of the Iron Molybdate Catalyst during Selective Oxidation of Methanol. ChemCatChem, 11 (19), 4871–4883. doi:10.1002/cctc.201901025
Walter, K. M.; Serrer, M.-A.; Kleist, W.; Grunwaldt, J.-D. (2019). Continuous production of higher alcohols from synthesis gas and ethanol using Cs-modified CuO/ZnO/Al
Goodman, E. D.; Johnston-Peck, A. C.; Dietze, E. M.; Wrasman, C. J.; Hoffman, A. S.; Abild-Pedersen, F.; Bare, S. R.; Plessow, P. N.; Cargnello, M. (2019). Catalyst deactivation via decomposition into single atoms and the role of metal loading. Nature catalysis, 2, 748–755. doi:10.1038/s41929-019-0328-1
Zhao, X.; Stökle, K.; Becker, G. C.; Zimmermann, M.; Kruse, A. (2019). Hydrothermal carbonization of Spirulina platensis and Chlorella vulgaris combined with protein isolation and struvite production. Bioresource technology reports, 6, 159–167. doi:10.1016/j.biteb.2019.01.006
Becker, G. C.; Wüst, D.; Köhler, H.; Lautenbach, A.; Kruse, A. (2019). Novel approach of phosphate-reclamation as struvite from sewage sludge by utilising hydrothermal carbonization. Journal of environmental management, 238, 119–125. doi:10.1016/j.jenvman.2019.02.121
Goncalves, T. J.; Plessow, P. N.; Studt, F. (2019). On the Accuracy of Density Functional Theory in Zeolite Catalysis. ChemCatChem, 11 (17), 4368–4376. doi:10.1002/cctc.201900791
Dabros, T. M. H.; Andersen, M. L.; Lindahl, S. B.; Hansen, T. W.; Høj, M.; Gabrielsen, J.; Grunwaldt, J.-D.; Jensen, A. D. (2019). Hydrodeoxygenation (HDO) of aliphatic oxygenates and phenol over NiMo/MgAl
Soares Dias, A. P.; Rego, F.; Fonseca, F.; Casquilho, M.; Rosa, F.; Rodrigues, A. (2019). Catalyzed pyrolysis of SRC poplar biomass. Alkaline carbonates and zeolites catalysts. Energy, 183, 1114–1122. doi:10.1016/j.energy.2019.07.009
Haltenort, P.; Lautenschütz, L.; Arnold, U.; Sauer, J. (2019). (Trans)acetalization Reactions for the Synthesis of Oligomeric Oxymethylene Dialkyl Ethers Catalyzed by Zeolite BEA25. Topics in catalysis, 62 (5-6), 551–559. doi:10.1007/s11244-019-01188-9
Tischer, S.; Börnhorst, M.; Amsler, J.; Schoch, G.; Deutschmann, O. (2019). Thermodynamics and reaction mechanism of urea decomposition. Physical chemistry, chemical physics, 21 (30), 16785–16797. doi:10.1039/C9CP01529A
Doronkin, D. E.; Benzi, F.; Zheng, L.; Sharapa, D. I.; Amidani, L.; Studt, F.; Roesky, P. W.; Casapu, M.; Deutschmann, O.; Grunwaldt, J.-D. (2019). NH
Tofighi, G.; Yu, X.; Lichtenberg, H.; Doronkin, D. E.; Wang, W.; Wöll, C.; Wang, Y.; Grunwaldt, J.-D. (2019). Chemical Nature of Microfluidically Synthesized AuPd Nanoalloys Supported on TiO₂. ACS catalysis, 9 (6), 5462–5473. doi:10.1021/acscatal.9b00161
Fahami, A. R.; Günter, T.; Doronkin, D. E.; Casapu, M.; Zengel, D.; Vuong, T. H.; Simon, M.; Breher, F.; Kucherov, A. V.; Brückner, A.; Grunwaldt, J.-D. (2019). The dynamic nature of Cu sites in Cu-SSZ-13 and the origin of the seagull NOx conversion profile during NH₃-SCR. Reaction chemistry & engineering, 4 (6), 1000–1018. doi:10.1039/c8re00290h
Stoll, I. K.; Boukis, N.; Neumann, A.; Ochsenreither, K.; Zevaco, T. A.; Sauer, J. (2019). The Complex Way to Sustainability: Petroleum-Based Processes versus Biosynthetic Pathways in the Formation of C4 Chemicals from Syngas. Industrial & engineering chemistry research, 58 (35), 15863–15871. doi:10.1021/acs.iecr.9b01123
Md Dostagir, S. N. H.; Awasthi, M. K.; Kumar, A.; Gupta, K.; Behrens, S.; Shrotri, A.; Singh, S. K. (2019). Selective Catalysis for Room-Temperature Hydrogenation of Biomass-Derived Compounds over Supported NiPd Catalysts in Water. ACS sustainable chemistry & engineering, 7 (10), 9352–9359. doi:10.1021/acssuschemeng.9b00486
Damergi, E.; Madi, H.; Sharma, S.; Boukis, N.; Marechal, F.; Van Herle, J.; Ludwig, C. (2019). A combined hydrothermal gasification - solid oxide fuel cell system for sustainable production of algal biomass and energy. Algal Research, 41, Art. Nr.: 101552. doi:10.1016/j.algal.2019.101552
Hoffmann, V.; Jung, D.; Zimmermann, J.; Rodriguez Correa, C.; Elleuch, A.; Halouani, K.; Kruse, A. (2019). Conductive Carbon Materials from the Hydrothermal Carbonization of Vineyard Residues for the Application in Electrochemical Double-Layer Capacitors (EDLCs) and Direct Carbon Fuel Cells (DCFCs). Materials, 12 (10), 1703. doi:10.3390/ma12101703
Liu, S.; Zhao, Z.-J.; Yang, C.; Zha, S.; Neyman, K. M.; Studt, F.; Gong, J. (2019). Adsorption preference determines segregation direction: A shortcut to more realistic surface models of alloy catalysts. ACS catalysis, 9 (6), 5011–5018. doi:10.1021/acscatal.9b00499
Tofighi, G.; Degler, D.; Junker, B.; Müller, S.; Lichtenberg, H.; Wang, W.; Weimar, U.; Barsan, N.; Grunwaldt, J.-D. (2019). Microfluidically synthesized Au, Pd and AuPd nanoparticles supported on SnO 2 for gas sensing applications. Sensors and actuators <Lausanne> / B, 292, 48–56. doi:10.1016/j.snb.2019.02.107
Plessow, P. N.; Smith, A.; Tischer, S.; Studt, F. (2019). Identification of the Reaction Sequence of the MTO Initiation Mechanism Using Ab Initio-Based Kinetics. Journal of the American Chemical Society, 141 (14), 5908–5915. doi:10.1021/jacs.9b00585
Guo, B.; Walter, V.; Hornung, U.; Dahmen, N. (2019). Hydrothermal liquefaction of Chlorella vulgaris and Nannochloropsis gaditana in a continuous stirred tank reactor and hydrotreating of biocrude by nickel catalysts. Fuel processing technology, 191, 168–180. doi:10.1016/j.fuproc.2019.04.003
Ille, Y.; Sánchez, F. A.; Dahmen, N.; Pereda, S. (2019). Multiphase Equilibria Modeling of Fast Pyrolysis Bio-Oils. Group Contribution Associating Equation of State Extension to Lignin Monomers and Derivatives. Industrial & engineering chemistry research, 58 (17), 7318–7331. doi:10.1021/acs.iecr.9b00227
Sánchez, F. A.; Ille, Y.; Dahmen, N.; Pereda, S. (2019). GCA-EOS extension to mixtures of phenol ethers and derivatives with hydrocarbons and water. Fluid phase equilibria, 490, 13–21. doi:10.1016/j.fluid.2019.02.017
Fonseca, F. G.; Funke, A.; Niebel, A.; Soares Dias, A. P.; Dahmen, N. (2019). Moisture content as a design and operational parameter for fast pyrolysis. Journal of analytical and applied pyrolysis, 139, 73–86. doi:10.1016/j.jaap.2019.01.012
Yu, S.; Fritz, B.; Johnsen, S.; Busko, D.; Richards, B. S.; Hippler, M.; Wiegand, G.; Tang, Y.; Li, Z.; Lemmer, U.; Hölscher, H.; Gomard, G. (2019). Enhanced Photoluminescence in Quantum Dots–Porous Polymer Hybrid Films Fabricated by Microcellular Foaming. Advanced optical materials, 7 (12), Article no: 1900223. doi:10.1002/adom.201900223
Sharapa, D. I.; Doronkin, D. E.; Studt, F.; Grunwaldt, J.-D.; Behrens, S. (2019). Moving Frontiers in Transition Metal Catalysis: Synthesis, Characterization and Modeling. Advanced materials, 31 (26), Art.Nr. 1807381. doi:10.1002/adma.201807381
Gaur, A.; Hartmann Dabros, T. M.; Høj, M.; Boubnov, A.; Prüssmann, T.; Jelic, J.; Studt, F.; Jensen, A. D.; Grunwaldt, J.-D. (2019). Probing the Active Sites of MoS 2 Based Hydrotreating Catalysts Using Modulation Excitation Spectroscopy. ACS catalysis, 9 (3), 2568–2579. doi:10.1021/acscatal.8b04778
Otromke, M.; Shuttleworth, P. S.; Sauer, J.; White, R. J. (2019). Hydrothermal base catalysed treatment of Kraft lignin - time dependent analysis and a techno-economic evaluation for carbon fibre applications. Bioresource technology reports, 6, 241–250. doi:10.1016/j.biteb.2019.03.008
Wang, C.; Zhu, W.; Chen, C.; Zhang, H.; Fan, Y.; Mu, B.; Zhong, J. (2019). Behavior of Phosphorus in Catalytic Supercritical Water Gasification of Dewatered Sewage Sludge: The Conversion Pathway and Effect of Alkaline Additive. Energy & fuels, 33 (2), 1290–1295. doi:10.1021/acs.energyfuels.8b04054
Goncalves, T. J.; Plessow, P. N.; Studt, F. (2019). A Computational Investigation of OME-synthesis through Homogeneous Acid Catalysis. ChemCatChem, 11 (7), 1949–1954. doi:10.1002/cctc.201900115
Torkashvand, B.; Lott, P.; Zengel, D.; Maier, L.; Hettel, M.; Grunwaldt, J.-D.; Deutschmann, O. (2019). Homogeneous oxidation of light alkanes in the exhaust of turbocharged lean-burn gas engines. The chemical engineering journal, 377, Article No.119800. doi:10.1016/j.cej.2018.08.186
Torkashvand, B.; Maier, L.; Hettel, M.; Schedlbauer, T.; Grunwaldt, J.-D.; Deutschmann, O. (2019). On the challenges and constrains of ultra-low emission limits: Formaldehyde oxidation in catalytic sinusoidal-shaped channels. Chemical engineering science, 195, 841–850. doi:10.1016/j.ces.2018.10.031
Gossler, H.; Maier, L.; Angeli, S.; Tischer, S.; Deutschmann, O. (2019). CaRMeN: An Improved Computer-Aided Method for Developing Catalytic Reaction Mechanisms. Catalysts, 9 (3), Article No.227. doi:10.3390/catal9030227
Li, J.; Ye, Y.; Ye, L.; Su, F.; Ma, Z.; Huang, J.; Xie, H.; Doronkin, D. E.; Zimina, A.; Grunwaldt, J.-D.; Zhou, Y. (2019). Sunlight induced photo-thermal synergistic catalytic CO2 conversion via localized surface plasmon resonance of MoO3-x. Journal of materials chemistry / A, 7 (6), 2821–2830. doi:10.1039/c8ta10922b
Gudun, K. A.; Segizbayev, M.; Adamov, A.; Plessow, P. N.; Lyssenko, K. A.; Balanay, M. P.; Khalimon, A. Y. (2019). POCN Ni(II) pincer complexes: synthesis, characterization and evaluation of catalytic hydrosilylation and hydroboration activities. Dalton transactions, 48 (5), 1732–1746. doi:10.1039/C8DT04854A
Wüst, D.; Rodriguez Correa, C.; Suwelack, K. U.; Köhler, H.; Kruse, A. (2019). Hydrothermal carbonization of dry toilet residues as an added-value strategy – Investigation of process parameters. Journal of environmental management, 234, 537–545. doi:10.1016/j.jenvman.2019.01.005
Stotz, H.; Maier, L.; Boubnov, A.; Gremminger, A.; Grunwaldt, J.-D.; Deutschmann, O. (2019). Surface reaction kinetics of methane oxidation over PdO. Journal of catalysis, 370, 152–175. doi:10.1016/j.jcat.2018.12.007
Dahmen, N.; Lewandowski, I.; Zibek, S.; Weidtmann, A. (2019). Integrated lignocellulosic value chains in a growing bioeconomy: Status quo and perspectives. Global change biology / Bioenergy, 11 (1), 107–117. doi:10.1111/gcbb.12586
Benel, C.; Fischer, A.; Zimina, A.; Steininger, R.; Kruk, R.; Hahn, H.; Léon, A. (2019). Controlling the structure and magnetic properties of cluster-assembled metallic glasses. Materials Horizons, 6 (4), 727–732. doi:10.1039/C8MH01013G
Benzinger, W.; Daymo, E.; Hettel, M.; Maier, L.; Antinori, C.; Pfeifer, P.; Deutschmann, O. (2019). Reverse Water Gas Shift (RWGS) over Ni - Spatially-Resolved Measurements and Simulations. The chemical engineering journal, 362, 430–441. doi:10.1016/j.cej.2019.01.038
Dan, M.; Wei, S.; Doronkin, D. E.; Li, Y.; Zhao, Z.; Yu, S.; Grunwaldt, J.-D.; Lin, Y.; Zhou, Y. (2019). Novel MnS/(In
Jamshidi, F.; Heimel, H.; Hasert, M.; Cai, X.; Deutschmann, O.; Marschall, H.; Wörner, M. (2019). On suitability of phase-field and algebraic volume-of-fluid OpenFOAM® solvers for gas-liquid microfluidic applications. Computer physics communications, 236, 72–85. doi:10.1016/j.cpc.2018.10.015
Schuler, J.; Hornung, U.; Dahmen, N.; Sauer, J. (2019). Lignin from bark as a resource for aromatics production by hydrothermal liquefaction. Global change biology / Bioenergy, 11 (1), 218–229. doi:10.1111/gcbb.12562
Rohde, V.; Böringer, S.; Tübke, B.; Adam, C.; Dahmen, N.; Schmiedl, D. (2019). Fractionation of three different lignins by thermal separation techniques - A comparative study. Global change biology / Bioenergy, 11 (SI, 1), 206–217. doi:10.1111/gcbb.12546
Otromke, M.; White, R. J.; Sauer, J. (2019). Hydrothermal Base Catalyzed Depolymerization and Conversion of Technical Lignin – An Introductory Review. Carbon Resources Conversion, 2, 59–71. doi:10.1016/j.crcon.2019.01.002
2018
Book Chapters
Dahmen, N.; Sauer, J.; Wodarz, S. (2018). Product and process cost assessment. Bioeconomy - Shaping the transition to a sustainable, biobased economy. Ed.: I. Lewandowski, 214–228, Springer International Publishing.
Hettel, M.; Wörner, M.; Deutschmann, O. (2018). Computational Fluid Dynamics of Catalytic Reactors. Handbook of Materials Modeling – Applications: Current and Emerging Materials. Ed.: W. Andreoni, 1–34, Springer International Publishing. doi:10.1007/978-3-319-50257-1_6-1
Journal Articles
Volpe, M.; Wüst, D.; Merzari, F.; Lucian, M.; Andreottola, G.; Kruse, A.; Fiori, L. (2018). One stage olive mill waste streams valorisation via hydrothermal carbonisation. Waste management, 80, 224–234. doi:10.1016/j.wasman.2018.09.021
Torkashvand, B.; Maier, L.; Lott, P.; Schedlbauer, T.; Grunwaldt, J.-D.; Deutschmann, O. (2018). Formaldehyde Oxidation Over Platinum: On the Kinetics Relevant to Exhaust Conditions of Lean-Burn Natural Gas Engines. Topics in catalysis, 62 (1-4), 206–213. doi:10.1007/s11244-018-1087-y
Sprenger, P.; Stehle, M.; Gaur, A.; Gänzler, A. M.; Gashnikova, D.; Kleist, W.; Grunwaldt, J.-D. (2018). Reactivity of Bismuth Molybdates for Selective Oxidation of Propylene Probed by Correlative Operando Spectroscopies. ACS catalysis, 8 (7), 6462–6475. doi:10.1021/acscatal.8b00696
Fan, Y. J.; Zhu, W.; Gong, M.; Su, Y.; Wang, C. Y. (2018). Investigation of the interaction between intermediates from gasification of biomass in supercritical water: Formaldehyde/formic acid mixtures. International journal of hydrogen energy, 43 (29), 13090–13097. doi:10.1016/j.ijhydene.2018.05.118
Kruse, A.; Dahmen, N. (2018). Hydrothermal biomass conversion: Quo vadis?. The journal of supercritical fluids, 134, 114–123. doi:10.1016/j.supflu.2017.12.035
Otromke, M.; Shuttleworth, P. S.; Sauer, J.; White, R. J. (2018). Hydrothermal base catalysed treatment of Kraft Lignin for the preparation of a sustainable carbon fibre precursor. Bioresource technology reports, 5, 251–260. doi:10.1016/j.biteb.2018.11.001
Arnold, S.; Moss, K.; Dahmen, N.; Henkel, M.; Hausmann, R. (2018). Pretreatment strategies for microbial valorization of bio-oil fractions produced by fast pyrolysis of ash-rich lignocellulosic biomass. Global change biology / Bioenergy, 11 (SI, 1), 181–190. doi:10.1111/gcbb.12544
Hackbarth, K.; Haltenort, P.; Arnold, U.; Sauer, J. (2018). Recent Progress in the Production, Application and Evaluation of Oxymethylene Ethers. Chemie - Ingenieur - Technik, 90 (10), 1520–1528. doi:10.1002/cite.201800068
Betz, M.; Arnold, U.; Sauer, J. (2018). Synthese von aromatenfreiem Benzin aus Ethanol. Chemie - Ingenieur - Technik, 90 (9), 1169. doi:10.1002/cite.201855080
Oyedun, A. O.; Kumar, A.; Oestreich, D.; Arnold, U.; Sauer, J. (2018). The development of the production cost of oxymethylene ethers as diesel additives from biomass. Biofuels, bioproducts and biorefining, 12 (4), 694–710. doi:10.1002/bbb.1887
Jung, D.; Zimmermann, M.; Kruse, A. (2018). Hydrothermal Carbonization of Fructose: Growth Mechanism and Kinetic Model. ACS sustainable chemistry & engineering, 6 (11), 13877–13887. doi:10.1021/acssuschemeng.8b02118
Sharapa, D.; Steiner, A.-K.; Amsharov, K. (2018). The Mechanism of Cyclodehydrofluorination on γ‐Alumina. Physica status solidi / B, 255 (12), Art.-Nr.: 1800189. doi:10.1002/pssb.201800189
Dotsenko, V. V.; Evmeshchenko, T. Y.; Aksenov, N. A.; Aksenova, I. V.; Krapivin, G. D.; Sharapa, D. I.; Chausov, F. F.; Strelkov, V. D.; Dyadyuchenko, L. V. (2018). Some New Reactions and Properties of Xanthane Hydride (5-Amino-1,2,4-dithiazole-3-thione). Russian journal of general chemistry, 88 (10), 2050–2057. doi:10.1134/S1070363218100043
Fan, Y.; Hornung, U.; Dahmen, N.; Kruse, A. (2018). Hydrothermal liquefaction of protein-containing biomass: study of model compounds for Maillard reactions. Biomass Conversion and Biorefinery, 8 (4), 909–923. doi:10.1007/s13399-018-0340-8
Staerz, A.; Boehme, I.; Degler, D.; Bahri, M.; Doronkin, D. E.; Zimina, A.; Brinkmann, H.; Herrmann, S.; Junker, B.; Ersen, O.; Grunwaldt, J.-D.; Weimar, U.; Barsan, N. (2018). Rhodium oxide surface-loaded gas sensors. Nanomaterials, 8 (11), Art. Nr.: 892. doi:10.3390/nano8110892
Dietze, E. M.; Abild-Pedersen, F.; Plessow, P. N. (2018). Comparison of Sintering by Particle Migration and Ripening through First-Principles-Based Simulations. The journal of physical chemistry <Washington, DC> / C, 122 (46), 26563–26569. doi:10.1021/acs.jpcc.8b09303
Fečík, M.; Plessow, P. N.; Studt, F. (2018). Simple Scheme to Predict Transition-State Energies of Dehydration Reactions in Zeolites with Relevance to Biomass Conversion. The journal of physical chemistry <Washington, DC> / C, 122 (40), 23062–23067. doi:10.1021/acs.jpcc.8b07659
Carriel Schmitt, C.; Gagliardi Reolon, M.; Zimmermann, M.; Raffelt, K.; Grunwaldt, J.-D.; Dahmen, N. (2018). Synthesis and Regeneration of Nickel-Based Catalysts for Hydrodeoxygenation of Beech Wood Fast Pyrolysis Bio-Oil. Catalysts, 8 (10), Article: 449. doi:10.3390/catal8100449
Baumann, A.; Gaona, X.; Yalçıntaş, E.; Dardenne, K.; Prüßmann, T.; Rothe, J.; Duckworth, S.; Altmaier, M.; Geckeis, H. (2018). Impact of nitrate on the redox chemistry and solubility of Tc(IV) in alkaline, dilute to concentrated aqueous NaCl solutions. Applied geochemistry, 98, 321–330. doi:10.1016/j.apgeochem.2018.10.007
Sprenger, P.; Sheppard, T. L.; Suuronen, J.-P.; Gaur, A.; Benzi, F.; Grunwaldt, J.-D. (2018). Structural evolution of highly active multicomponent catalysts for selective propylene oxidation. Catalysts, 8 (9), Art. Nr.: 356. doi:10.3390/catal8090356
Ille, Y.; Kröhl, F.; Velez, A.; Funke, A.; Pereda, S.; Schaber, K.; Dahmen, N. (2018). Activity of water in pyrolysis oil—Experiments and modelling. Journal of analytical and applied pyrolysis, 135, 260–270. doi:10.1016/j.jaap.2018.08.027
Dietrich, C.; Uzunidis, G.; Träutlein, Y.; Behrens, S. (2018). Synthesis of Bimetallic Pt/Sn-based Nanoparticles in Ionic Liquids. Journal of visualized experiments, (138), e58058. doi:10.3791/58058
Plessow, P. N.; Studt, F. (2018). Olefin methylation and cracking reactions in H-SSZ-13 investigated with ab initio and DFT calculations. Catalysis science & technology, 8 (17), 4420–4429. doi:10.1039/C8CY01194J
Rohde, V.; Hahn, T.; Wagner, M.; Böringer, S.; Tübke, B.; Brosse, N.; Dahmen, N.; Schmiedl, D. (2018). Potential of a short rotation coppice poplar as a feedstock for platform chemicals and lignin-based building blocks. Industrial crops and products, 123, 698–706. doi:10.1016/j.indcrop.2018.07.034
Yoo, J. S.; Schumann, J.; Studt, F.; Abild-Pedersen, F.; Nørskov, J. K. (2018). Theoretical Investigation of Methane Oxidation on Pd(111) and Other Metallic Surfaces. The journal of physical chemistry <Washington, DC> / C, 122 (28), 16023–16032. doi:10.1021/acs.jpcc.8b02142
Schade, O. R.; Kalz, K. F.; Neukum, D.; Kleist, W.; Grunwaldt, J.-D. (2018). Supported gold- and silver-based catalysts for the selective aerobic oxidation of 5-(hydroxymethyl)furfural to 2,5-furandicarboxylic acid and 5-hydroxymethyl-2-furancarboxylic acid. Green chemistry, 20 (15), 3530–3541. doi:10.1039/C8GC01340C
Kerkeni, B.; Berthout, D.; Berthomieu, D.; Doronkin, D. E.; Casapu, M.; Grunwaldt, J.-D.; Chizallet, C. (2018). Copper Coordination to Water and Ammonia in Cuᴵᴵ-Exchanged SSZ-13: Atomistic Insights from DFT Calculations and in Situ XAS Experiments. The journal of physical chemistry <Washington, DC> / C, 122 (29), 16741–16755. doi:10.1021/acs.jpcc.8b03572
Funke, A.; Grandl, R.; Ernst, M.; Dahmen, N. (2018). Modelling and improvement of heat transfer coefficient in auger type reactors for fast pyrolysis application. Chemical engineering and processing, 130, 67–75. doi:10.1016/j.cep.2018.05.023
Boscagli, C.; Tomasi Morgano, M.; Raffelt, K.; Leibold, H.; Grunwaldt, J.-D. (2018). Influence of feedstock, catalyst, pyrolysis and hydrotreatment temperature on the composition of upgraded oils from intermediate pyrolysis. Biomass and bioenergy, 116, 236–248. doi:10.1016/j.biombioe.2018.06.022
Kruse, A.; Zevaco, T. (2018). Properties of Hydrochar as Function of Feedstock, Reaction Conditions and Post-Treatment. Energies, 11 (3), 674. doi:10.3390/en11030674
Gong, M.; Wang, Y.; Fan, Y.; Zhu, W.; Zhang, H.; Su, Y. (2018). Polycyclic aromatic hydrocarbon formation during the gasification of sewage sludge in sub- and supercritical water: Effect of reaction parameters and reaction pathways. Waste management, 72, 287–295. doi:10.1016/j.wasman.2017.11.024
Henrich, T.; Abeln, J.; Betz, M. (2018). Einstufige Dimethylethersynthese: Modellierung der Kinetik aus isothermen, experimentellen Daten [Direct Dimethyl Ether Synthesis: Modelling of the Kinetics from Isothermal, Experimental Data]. Chemie - Ingenieur - Technik, 90 (3), 307–315. doi:10.1002/cite.201600131
Gentzen, M.; Doronkin, D. E.; Sheppard, T. L.; Grunwaldt, J.-D.; Sauer, J.; Behrens, S. (2018). An intermetallic Pd₂Ga nanoparticle catalyst for the single-step conversion of CO-rich synthesis gas to dimethyl ether. Applied catalysis / A, 562, 206–214. doi:10.1016/j.apcata.2018.04.018
Schmitt, C. C.; Raffelt, K.; Zimina, A.; Krause, B.; Otto, T.; Rapp, M.; Grunwaldt, J.-D.; Dahmen, N. (2018). Hydrotreatment of Fast Pyrolysis Bio-oil Fractions Over Nickel-Based Catalyst. Topics in catalysis, 61 (15-17), 1769–1782. doi:10.1007/s11244-018-1009-z
Stoll, K. I.; Herbig, S.; Zwick, M.; Boukis, N.; Sauer, J.; Neumann, A.; Oswald, F. (2018). Fermentation of H₂ and CO₂ with Clostridium ljungdahlii at Elevated Process Pressure – First Experimental Results. Chemical engineering transactions, 64, 151–156. doi:10.3303/CET1864026
Gossler, H.; Maier, L.; Angeli, S.; Tischer, S.; Deutschmann, O. (2018). CaRMeN: a tool for analysing and deriving kinetics in the real world. Physical chemistry, chemical physics, 20 (16), 10857–10876. doi:10.1039/C7CP07777G
Sauer, J.; Klemm, E. (2018). Chemische Reaktionstechnik in Zeiten der Energiewende. Chemie - Ingenieur - Technik, 90 (5), 575. doi:10.1002/cite.201870052
Etzold, B. J. M.; Nieken, U.; Sauer, J.; Ziegenbalg, D. (2018). Technische Chemie 2017 (Trenbericht). Nachrichten aus der Chemie, 66 (5), 484–485.
Dietze, E. M.; Plessow, P. N. (2018). Kinetic Monte Carlo Model for Gas Phase Diffusion in Nanoscopic Systems. The journal of physical chemistry <Washington, DC> / C, 122 (21), 11524–11531. doi:10.1021/acs.jpcc.8b01816
Schumann, J.; Medford, A. J.; Yoo, J. S.; Zhao, Z.; Bothra, P.; Cao, A.; Studt, F.; Abild-Pedersen, F.; Nørskov, J. K. (2018). Selectivity of Synthesis Gas Conversion to C
Gentzen, M.; Doronkin, D. E.; Sheppard, T. L.; Grunwaldt, J. D.; Sauer, J.; Behrens, S. (2018). Bifunctional catalysts based on colloidal Cu/Zn nanoparticles for the direct conversion of synthesis gas to dimethyl ether and hydrocarbons. Applied catalysis / A, 557, 99–107. doi:10.1016/j.apcata.2018.03.008
Wörner, M.; Cai, X.; Alla, H.; Yue, P. (2018). A semi-analytical method to estimate the effective slip length of spreading spherical-cap shaped droplets using Cox theory. Fluid dynamics research, 50 (3), 035501. doi:10.1088/1873-7005/aaaef6
Steinbach, D.; Kruse, A.; Sauer, J.; Vetter, P. (2018). Sucrose Is a Promising Feedstock for the Synthesis of the Platform Chemical Hydroxymethylfurfural. Energies, 11 (3), 645. doi:10.3390/en11030645
Fink, V.; Cai, X.; Stroh, A.; Bernard, R.; Kriegseis, J.; Frohnapfel, B.; Marschall, H.; Wörner, M. (2018). Drop bouncing by micro-grooves. International journal of heat and fluid flow, 70, 271–278. doi:10.1016/j.ijheatfluidflow.2018.02.014
Haltenort, P.; Hackbarth, K.; Oestreich, D.; Lautenschütz, L.; Arnold, U.; Sauer, J. (2018). Heterogeneously catalyzed synthesis of oxymethylene dimethyl ethers (OME) from dimethyl ether and trioxane. Catalysis communications, 109, 80–84. doi:10.1016/j.catcom.2018.02.013
Oswald, F.; Stoll, I. K.; Zwick, M.; Herbig, S.; Sauer, J.; Boukis, N.; Neumann, A. (2018). Formic Acid Formation by
Tofighi, G.; Gaur, A.; Doronkin, D. E.; Lichtenberg, H.; Wang, W.; Wang, D.; Rinke, G.; Ewinger, A.; Dittmeyer, R.; Grunwaldt, J.-D. (2018). Microfluidic Synthesis of Ultrasmall AuPd Nanoparticles with a Homogeneously Mixed Alloy Structure in Fast Continuous Flow for Catalytic Applications. The journal of physical chemistry <Washington, DC> / C, 122 (3), 1721–1731. doi:10.1021/acs.jpcc.7b11383
Langhorst, T.; Toedter, O.; Koch, T.; Niethammer, B.; Arnold, U.; Sauer, J. (2018). Investigations on Spark and Corona Ignition of Oxymethylene Ether-1 and Dimethyl Carbonate Blends with Gasoline by High-Speed Evaluation of OH* Chemiluminescence. SAE International journal of fuels and lubricants, 11 (1), 5–20. doi:10.4271/04-11-01-0001
Mutz, B.; Sprenger, P.; Wang, W.; Wang, D.; Kleist, W.; Grunwaldt, J.-D. (2018). Operando Raman Spectroscopy on CO₂ Methanation Over Alumina-Supported Ni, Ni₃Fe and NiRh
Plessow, P. N.; Studt, F. (2018). Theoretical Insights into the Effect of the Framework on the Initiation Mechanism of the MTO Process. Catalysis letters, 148 (4), 1246–1253. doi:10.1007/s10562-018-2330-7
Dieguez-Alonso, A.; Funke, A.; Anca-Couce, A.; Rombolà, A.; Ojeda, G.; Bachmann, J.; Behrendt, F. (2018). Towards Biochar and Hydrochar Engineering—Influence of Process Conditions on Surface Physical and Chemical Properties, Thermal Stability, Nutrient Availability, Toxicity and Wettability. Energies, 11 (3), 496. doi:10.3390/en11030496
Funke, A.; Demus, T.; Willms, T.; Schenke, L.; Echterhof, T.; Niebel, A.; Pfeifer, H.; Dahmen, N. (2018). Application of fast pyrolysis char in an electric arc furnace. Fuel processing technology, 174, 61–68. doi:10.1016/j.fuproc.2018.02.013
Plessow, P. N. (2018). Efficient Transition State Optimization of Periodic Structures through Automated Relaxed Potential Energy Surface Scans. Journal of chemical theory and computation, 14 (2), 981–990. doi:10.1021/acs.jctc.7b01070
Niethammer, B.; Wodarz, S.; Betz, M.; Haltenort, P.; Oestreich, D.; Hackbarth, K.; Arnold, U.; Otto, T.; Sauer, J. (2018). Alternative Liquid Fuels from Renewable Resources. Chemie - Ingenieur - Technik, 90 (1-2), 99–112. doi:10.1002/cite.201700117
Grunwaldt, J.-D.; Lichtenberg, H.; Rothe, J. (2018). Inauguration Workshop of the CAT-ACT Beamline for Catalysis and Radionuclide Research at ANKA. Synchrotron radiation news, 31 (1), 16–19. doi:10.1080/08940886.2018.1409551
Giehr, A.; Maier, L.; Schunk, S. A.; Deutschmann, O. (2018). Thermodynamic Considerations on the Oxidation State of Co/γ-Al₂O₃ and Ni/γ-Al₂O₃ Catalysts under Dry and Steam Reforming Conditions. ChemCatChem, 10 (4), 751–757. doi:10.1002/cctc.201701376
Kulkarni, A. R.; Zhao, Z.-J.; Siahrostami, S.; Nørskov, J. K.; Studt, F. (2018). Cation-exchanged zeolites for the selective oxidation of methane to methanol. Catalysis science & technology, 8 (1), 114–123. doi:10.1039/c7cy01229b
Oestreich, D.; Lautenschütz, L.; Arnold, U.; Sauer, J. (2018). Production of oxymethylene dimethyl ether (OME)-hydrocarbon fuel blends in a one-step synthesis/extraction procedure. Fuel, 214, 39–44. doi:10.1016/j.fuel.2017.10.116
Hartmann Dabros, T. M.; Gaur, A.; Pintos, D. G.; Sprenger, P.; Høj, M.; Hansen, T. W.; Studt, F.; Gabrielsen, J.; Grunwaldt, J.-D.; Jensen, A. D. (2018). Influence of H₂O and H₂S on the composition, activity, and stability of sulfided Mo, CoMo, and NiMo supported on MgAl₂O₄ for hydrodeoxygenation of ethylene glycol. Applied catalysis / A, 551, 106–121. doi:10.1016/j.apcata.2017.12.008
Müller, S. A.; Degler, D.; Feldmann, C.; Türk, M.; Moos, R.; Fink, K.; Studt, F.; Gerthsen, D.; Barsan, N.; Grunwaldt, J.-D. (2018). Exploiting Synergies in Catalysis and Gas Sensing using Noble Metal-Loaded Oxide Composites. ChemCatChem, 10 (5), 864–880. doi:10.1002/cctc.201701545
Degler, D.; Müller, S. A.; Doronkin, D. E.; Wang, D.; Grunwaldt, J.-D.; Weimar, U.; Barsan, N. (2018). Platinum loaded tin dioxide: a model system for unravelling the interplay between heterogeneous catalysis and gas sensing. Journal of materials chemistry / A, 6 (5), 2034–2046. doi:10.1039/C7TA08781K
Woo, M.; Wörner, M.; Tischer, S.; Deutschmann, O. (2018). Validation of a numerical method for interface-resolving simulation of multicomponent gas-liquid mass transfer and evaluation of multicomponent diffusion models. Heat and mass transfer, 54 (3), 697–713. doi:10.1007/s00231-017-2145-x
Hettel, M.; Daymo, E. A.; Deutschmann, O. (2018). 3D modeling of a CPOX-reformer including detailed chemistry and radiation effects with DUO. Computers & chemical engineering, 109, 166–178. doi:10.1016/j.compchemeng.2017.11.005
Breunig, M.; Gebhart, P.; Hornung, U.; Kruse, A.; Dinjus, E. (2018). Direct liquefaction of lignin and lignin rich biomasses by heterogenic catalytic hydrogenolysis. Biomass and bioenergy, 111, 352–360. doi:10.1016/j.biombioe.2017.06.001
Kaminske, V.; Wiegand, G. (2018). 50 Jahre Plattentektonik: Offene Fragen und mögliche Antworten. Naturwissenschaftliche Rundschau, 71 (3).
2017
Book Chapters
Dahmen, N.; Henrich, E.; Henrich, T. (2017). Synthesis Gas Biorefinery. Biorefineries. Ed.: K. Wagemann, 217–245, Springer International Publishing. doi:10.1007/10_2016_63
Raffelt, K.; Nicoleit, T.; Dahmen, N.; Sauer; Joerg. (2017). Bio-Slurries From Lignocellulose. Encyclopedia of Sustainable Technologies. Ed. by Abraham, Martin, 217–228, Elsevier.
Marschall, H.; Falconi, C.; Lehrenfeld, C.; Abiev, R.; Wörner, M.; Reusken, A.; Bothe, D. (2017). Direct Numerical Simulations of Taylor Bubbles in a Square Mini-Channel: Detailed Shape and Flow Analysis with Experimental Validation. Transport Processes at Fluidic Interfaces. Ed.: D. Bothe, 663–679, Springer International Publishing. doi:10.1007/978-3-319-56602-3_23
Wörner, M. (2017). Taylor Bubbles in Small Channels: A Proper Guiding Measure for Validation of Numerical Methods for Interface Resolving Simulations. Transport Processes at Fluidic Interfaces. Ed.: D. Bothe, 577–587, Springer International Publishing. doi:10.1007/978-3-319-56602-3_19
Doronkin, D. E.; Lichtenberg, H.; Grunwaldt, J.-D. (2017). Cell designs for in situ and operando studies. XAFS Techniques for Catalysts, Nanomaterials, and Surfaces. Ed.: Y. Iwasawa, 75–89, Springer. doi:10.1007/978-3-319-43866-5_6
Journal Articles
Traulsen, M. L.; Carvalho, H. W. P. de; Zielke, P.; Grunwaldt, J.-D. (2017). The Effect of Electrical Polarization on Electronic Structure in LSM Electrodes: An Operando XAS, RIXS and XES Study. Journal of the Electrochemical Society, 164 (10), F3064–F3072. doi:10.1149/2.0091710jes
Baier, S.; Damsgaard, C. D.; Klumpp, M.; Reinhardt, J.; Sheppard, T.; Balogh, Z.; Kasama, T.; Benzi, F.; Wagner, J. B.; Schwieger, W.; Schroer, C. G.; Grunwaldt, J.-D. (2017). Stability of a Bifunctional Cu-Based Core@Zeolite Shell Catalyst for Dimethyl Ether Synthesis Under Redox Conditions Studied by Environmental Transmission Electron Microscopy and In Situ X-Ray Ptychography. Microscopy and microanalysis, 23 (3), 501–512. doi:10.1017/S1431927617000332
Alexopoulou, K. I.; Leibold, M.; Walter, O.; Zevaco, T. A.; Schindler, S. (2017). Synthesis and characterization of a series of nickel complexes with tripodal and related ligands: electroreductive coupling of alkynes and carbon dioxide. European journal of inorganic chemistry, 2017 (40), 4722–4732. doi:10.1002/ejic.201700854
Zimina, A.; Dardenne, K.; Denecke, M. A.; Doronkin, D. E.; Huttel, E.; Lichtenberg, H.; Mangold, S.; Pruessmann, T.; Rothe, J.; Spangenberg, T.; Steininger, R.; Vitova, T.; Geckeis, H.; Grunwaldt, J.-D. (2017). CAT-ACT—A new highly versatile x-ray spectroscopy beamline for catalysis and radionuclide science at the KIT synchrotron light facility ANKA. Review of scientific instruments, 88 (11), Art. Nr.: 113113. doi:10.1063/1.4999928
Lange, J.; Müller, F.; Bernecker, K.; Dahmen, N.; Takors, R.; Blombach, B. (2017). Valorization of pyrolysis water : A biorefinery side stream, for 1,2-propanediol production with engineered Corynebacterium glutamicum. Biotechnology for biofuels, 10 (1), Art.Nr.: 277. doi:10.1186/s13068-017-0969-8
Silve, A.; Papachristou, I.; Wüstner, R.; Sträßner, R.; Schirmer, M.; Leber, K.; Guo, B.; Interrante, L.; Posten, C.; Frey, W. (2017). Extraction of lipids from wet microalga Auxenochlorella protothecoides using pulsed electric field treatment and ethanol-hexane blends. Algal Research, 29, 212–222. doi:10.1016/j.algal.2017.11.016
Castello, D.; Rolli, B.; Kruse, A.; Fiori, L. (2017). Supercritical Water Gasification of Biomass in a Ceramic Reactor: Long-Time Batch Experiments. Energies, 10 (11), Art. Nr.: 1734. doi:10.3390/en10111734
Gdovinová, V.; Schroer, M. A.; Tomašovičová, N.; Appel, I.; Behrens, S.; Majorošová, J.; Kováč, J.; Svergun, D. I.; Kopčanský, P. (2017). Structuralization of magnetic nanoparticles in 5CB liquid crystals. Soft matter, 13 (43), 7890–7896. doi:10.1039/C7SM01234A
Plessow, P. N.; Studt, F. (2017). Unraveling the Mechanism of the Initiation Reaction of the Methanol to Olefins Process Using ab Initio and DFT Calculations. ACS catalysis, 7 (11), 7987–7994. doi:10.1021/acscatal.7b03114
Mutz, B.; Gänzler, A. M.; Nachtegaal, M.; Müller, O.; Frahm, R.; Kleist, W.; Grunwaldt, J.-D. (2017). Surface Oxidation of Supported Ni Particles and Its Impact on the Catalytic Performance during Dynamically Operated Methanation of CO₂. Catalysts, 7 (9), 279. doi:10.3390/catal7090279
Siahrostami, S.; Li, G.; Nørskov, J. K.; Studt, F. (2017). Trends in Adsorption Energies of the Oxygenated Species on Single Platinum Atom Embedded in Carbon Nanotubes. Catalysis letters, 147 (11), 1–8. doi:10.1007/s10562-017-2200-8
Ferri, D.; Gaur, A.; Grunwaldt, J.-D. (2017). Genesis of a Co-Salicylaldimine Complex on Silica Followed in Situ by FTIR and XAS. ChemPhysChem, 18 (20), 2835–2839. doi:10.1002/cphc.201700550
Mutz, B.; Belimov, M.; Wang, W.; Sprenger, P.; Serrer, M.-A.; Wang, D.; Pfeifer, P.; Kleist, W.; Grunwaldt, J.-D. (2017). Potential of an Alumina-Supported Ni₃Fe Catalyst in the Methanation of CO₂: Impact of Alloy Formation on Activity and Stability. ACS catalysis, 7 (10), 6802–6814. doi:10.1021/acscatal.7b01896
Tofighi, G.; Lichtenberg, H.; Pesek, J.; Sheppard, T. L.; Wang, W.; Schöttner, L.; Rinke, G.; Dittmeyer, R.; Grunwaldt, J.-D. (2017). Continuous microfluidic synthesis of colloidal ultrasmall gold nanoparticles : in situ study of the early reaction stages and application for catalysis. Reaction chemistry & engineering, 2 (6), 876–884. doi:10.1039/C7RE00114B
Yang, C.; Yu, X.; Pleßow, P. N.; Heißler, S.; Weidler, P. G.; Nefedov, A.; Studt, F.; Wang, Y.; Wöll, C. (2017). Rendering Photoreactivity to Ceria: The Role of Defects. Angewandte Chemie / International edition, 56 (45), 14301–14305. doi:10.1002/anie.201707965
Rumancev, C.; Gundlach, A. R. von; Baier, S.; Wittstock, A.; Shi, J.; Benzi, F.; Senkbeil, T.; Stuhr, S.; Garamusx, V. M.; Grunwaldt, J.-D.; Rosenhahn, A. (2017). Morphological analysis of cerium oxide stabilized nanoporous gold catalysts by soft X-ray ASAXS. RSC Advances, 7 (72), 45344–45350. doi:10.1039/C7RA05396G
Shi, X.; Siahrostami, S.; Li, G.-L.; Zhang, Y.; Chakthranont, P.; Studt, F.; Jaramillo, T. F.; Zheng, X.; Nørskov, J. K. (2017). Understanding activity trends in electrochemical water oxidation to form hydrogen peroxide. Nature Communications, 8 (1), Art. Nr.: 701. doi:10.1038/s41467-017-00585-6
Benzi, F.; Sheppard, T. L.; Doronkin, D. E.; Meira, D. M.; Gänzler, A. M.; Baier, S.; Grunwaldt, J.-D. (2017). Transient structural and catalytic behaviour of Pt-particles probed by operando spectroscopy during a realistic driving cycle. Catalysis science & technology, 7 (18), 3999–4006. doi:10.1039/c7cy00926g
Kannepalli, S.; Gremminger, A.; Tischer, S.; Deutschmann, O. (2017). Optimization of axial catalyst loading in transient-operated zone-structured monoliths : Reduction of cumulative emissions in automotive oxidation catalysts. Chemical engineering science, 174, 189–202. doi:10.1016/j.ces.2017.09.013
Hwang, H.; Sahin, O.; Choi, J. (2017). Manufacturing a super-active carbon using fast pyrolysis char from biomass and correlation study on structural features and phenol adsorption. RSC Advances, 7 (67), 42192–42202. doi:10.1039/c7ra06910c
Krause, B.; Stube, M.; Zimin, A.; Steininger, R.; Trappen, M.; Ulrich, S.; Kashani, S. M. M.; Baumbach, T. (2017). Theoretical and experimental study of the gradient properties and the resulting local crystalline structure and orientation in magnetron-sputtered CrAlN coatings with lateral composition and thickness gradient. Journal of applied crystallography, 50, 1000–1010. doi:10.1107/S1600576717006513
Raupp, Y. S.; Yildiz, C.; Kleist, W.; Meier, M. A. R. (2017). Aerobic oxidation of α-pinene catalyzed by homogeneous and MOF-based Mn catalysts. Applied catalysis / A, 546, 1–6. doi:10.1016/j.apcata.2017.07.047
Mahbub, N.; Oyedun, A. O.; Kumar, A.; Oestreich, D.; Arnold, U.; Sauer, J. (2017). A life cycle assessment of oxymethylene ether synthesis from biomass-derived syngas as a diesel additive. Journal of cleaner production, 165, 1249–1262. doi:10.1016/j.jclepro.2017.07.178
Boscagli, C.; Raffelt, K.; Grunwaldt, J.-D. (2017). Reactivity of platform molecules in pyrolysis oil and in water during hydrotreatment over nickel and ruthenium catalysts. Biomass and bioenergy, 106, 63–73. doi:10.1016/j.biombioe.2017.08.013
Cai, X.; Wörner, M.; Marschall, H.; Deutschmann, O. (2017). CFD Simulation of Liquid Back Suction and Gas Bubble Formation in a Circular Tube with Sudden or Gradual Expansion. Emission control science and technology, 3 (4), 289–301. doi:10.1007/s40825-017-0073-3
Boukis, N.; Hauer, E.; Herbig, S.; Sauer, J.; Vogel, F. (2017). Catalytic gasification of digestate sludge in supercritical water on the pilot plant scale. Biomass Conversion and Biorefinery, 7 (4), 415–424. doi:10.1007/s13399-017-0238-x
Sprenger, P.; Kleist, W.; Grunwaldt, J.-D. (2017). Recent Advances in Selective Propylene Oxidation over Bismuth Molybdate Based Catalysts: Synthetic, Spectroscopic, and Theoretical Approaches. ACS catalysis, 7 (9), 5628–5642. doi:10.1021/acscatal.7b01149
Lautenschütz, L.; Oestreich, D.; Seidenspinner, P.; Arnold, U.; Dinjus, E.; Sauer, J. (2017). Corrigendum to "Physico-chemical properties and fuel characteristics of oxymethylene dialkyl ethers" [Fuel 173 (2016) 129-137]. Fuel, 209, 812. doi:10.1016/j.fuel.2017.07.083
Boscagli, C.; Yang, C.; Welle, A.; Wang, W.; Behrens, S.; Raffelt, K.; Grunwaldt, J.-D. (2017). Effect of pyrolysis oil components on the activity and selectivity of nickel-based catalysts during hydrotreatment. Applied catalysis / A, 544, 161–172. doi:10.1016/j.apcata.2017.07.025
Vitova, T.; Pidchenko, I.; Fellhauer, D.; Bagus, P. S.; Joly, Y.; Pruessmann, T.; Bahl, S.; Gonzalez-Robles, E.; Rothe, J.; Altmaier, M.; Denecke, M. A.; Geckeis, H. (2017). The role of the 5f valence orbitals of early actinides in chemical bonding. Nature Communications, 8, 16053. doi:10.1038/ncomms16053
Chakraborty, D.; Damsgaard, C. D.; Silva, H.; Conradsen, C.; Olsen, J. L.; Carvalho, H. W. P.; Mutz, B.; Bligaard, T.; Hoffmann, M. J.; Grunwaldt, J.-D.; Studt, F.; Chorkendorff, I. (2017). Bottom-Up Design of a Copper-Ruthenium Nanoparticulate Catalyst for Low-Temperature Ammonia Oxidation. Angewandte Chemie / International edition, 56 (30), 8711–8715. doi:10.1002/anie.201703468
Sheppard, T. L.; Price, S. W. T.; Benzi, F.; Baier, S.; Klumpp, M.; Dittmeyer, R.; Schwieger, W.; Grunwaldt, J.-D. (2017). In Situ Multimodal 3D Chemical Imaging of a Hierarchically Structured Core@Shell Catalyst. Journal of the American Chemical Society, 139 (23), 7855–7863. doi:10.1021/jacs.7b02177
Egeberg, A.; Dietrich, C.; Kind, C.; Popescu, R.; Gerthsen, D.; Behrens, S.; Feldmann, C. (2017). Bimetallic Nickel-Iridium and Nickel-Osmium Alloy Nanoparticles and Their Catalytic Performance in Hydrogenation Reactions. ChemCatChem, 9 (18), 3534–3543. doi:10.1002/cctc.201700168
Schachtl, E.; Yoo, J. S.; Gutiérrez, O. Y.; Studt, F.; Lercher, J. A. (2017). Impact of Ni promotion on the hydrogenation pathways of phenanthrene on MoS2/γ-Al2O3. Journal of catalysis, 352, 171–181. doi:10.1016/j.jcat.2017.05.003
Klemm, E.; Kraume, M.; Ritter, J.; Sauer, J. (2017). Reaktionstechnik und Mischvorgänge: Zwei untrennbare Fachgebiete. Chemie - Ingenieur - Technik, 89 (4), 355. doi:10.1002/cite.201770042
Llevot, A.; Monney, B.; Sehlinger, A.; Behrens, S.; Meier, M. A. R. (2017). Highly efficient Tsuji–Trost allylation in water catalyzed by Pd-nanoparticles. Chemical communications, 53 (37), 5175–5178. doi:10.1039/C7CC02380D
Syurik, J.; Siddique, R. H.; Dollmann, A.; Gomard, G.; Schneider, M.; Worgull, M.; Wiegand, G.; Hölscher, H. (2017). Bio-inspired, large scale, highly-scattering films for nanoparticle-alternative white surfaces. Scientific reports, 7, Art. Nr.: 46637. doi:10.1038/srep46637
Zhang, S.; Fu, R.; Wang, S.; Gu, Y.; Chen, S. (2017). Novel nanocellulose/conducting polymer composite nanorod films with improved electrochromic performances. Materials letters, 202, 127–130. doi:10.1016/j.matlet.2017.05.044
Steinbach, D.; Kruse, A.; Sauer, J. (2017). Pretreatment technologies of lignocellulosic biomass in water in view of furfural and 5-hydroxymethylfurfural production- A review. Biomass Conversion and Biorefinery, 7 (2), 247–274. doi:10.1007/s13399-017-0243-0
Goncalves, T. J.; Arnold, U.; Plessow, P. N.; Studt, F. (2017). Theoretical Investigation of the Acid Catalyzed Formation of Oxymethylene Dimethyl Ethers from Trioxane and Dimethoxymethane. ACS catalysis, 7 (5), 3615–3621. doi:10.1021/acscatal.7b00701
Sun, C.; Klumpp, M.; Binder, J. R.; Pfeifer, P.; Dittmeyer, R. (2017). Einstufige Treibstoffsynthese mittels gedruckter Katalysatorschichten in mikrostrukturierten Reaktoren = One-Stage Syngas-to-Fuel Conversion with Printed Catalyst Layers in Microstructured Reactors. Chemie - Ingenieur - Technik, 89 (7), 894–902. doi:10.1002/cite.201600180
Lautenschütz, L.; Oestreich, D.; Haltenort, P.; Arnold, U.; Dinjus, E.; Sauer, J. (2017). Efficient synthesis of oxymethylene dimethyl ethers (OME) from dimethoxymethane and trioxane over zeolites. Fuel processing technology, 165, 27–33. doi:10.1016/j.fuproc.2017.05.005
Chou, C.- wen; Kurz, C.; Hume, D. B.; Plessow, P. N.; Leibrandt, D. R.; Leibfried, D. (2017). Preparation and coherent manipulation of pure quantum states of a single molecular ion. Nature <London>, 545 (7653), 203–207. doi:10.1038/nature22338
Hengst, K.; Ligthart, D. A. J. M.; Doronkin, D. E.; Walter, K. M.; Kleist, W.; Hensen, E. J. M.; Grunwaldt, J.-D. (2017). Continuous Synthesis of γ-Valerolactone in a Trickle-Bed Reactor over Supported Nickel Catalysts. Industrial & engineering chemistry research, 56 (10), 2680–2689. doi:10.1021/acs.iecr.6b03493
Syurik, J.; Schwaiger, R.; Sudera, P.; Weyand, S.; Johnsen, S.; Wiegand, G.; Hölscher, H. (2017). Bio-inspired micro-to-nanoporous polymers with tunable stiffness. Beilstein journal of nanotechnology, 8, 906–914. doi:10.3762/bjnano.8.92
Hensley, A. J. R.; Ghale, K.; Rieg, C.; Dang, T.; Anderst, E.; Studt, F.; Campbell, C. T.; McEwen, J.-S.; Xu, Y. (2017). DFT-Based Method for More Accurate Adsorption Energies: An Adaptive Sum of Energies from RPBE and vdW Density Functionals. The journal of physical chemistry <Washington, DC> / C, 121 (9), 4937–4945. doi:10.1021/acs.jpcc.6b10187
Nie, Z.; Finck, N.; Heberling, F.; Pruessmann, T.; Liu, C.; Lützenkirchen, J. (2017). Adsorption of Selenium and Strontium on Goethite: EXAFS Study and Surface Complexation Modeling of the Ternary Systems. Environmental science & technology, 51 (7), 3751–3758. doi:10.1021/acs.est.6b06104
Li, L.; Plessow, P. N.; Rieger, M.; Sauer, S.; Sánchez-Carrera, R. S.; Schaefer, A.; Abild-Pedersen, F. (2017). Modeling the Migration of Platinum Nanoparticles on Surfaces Using a Kinetic Monte Carlo Approach. The journal of physical chemistry <Washington, DC> / C, 121 (8), 4261–4269. doi:10.1021/acs.jpcc.6b11549
Funke, A.; Tomasi Morgano, M.; Dahmen, N.; Leibold, H. (2017). Experimental comparison of two bench scale units for fast and intermediate pyrolysis. Journal of analytical and applied pyrolysis, 124, 504–514. doi:10.1016/j.jaap.2016.12.033
Deutsch, D.; Oestreich, D.; Lautenschütz, L.; Haltenort, P.; Arnold, U.; Sauer, J. (2017). High Purity Oligomeric Oxymethylene Ethers as Diesel Fuels. Chemie - Ingenieur - Technik, 89 (4), 486–489. doi:10.1002/cite.201600158
Oestreich, D.; Lautenschütz, L.; Arnold, U.; Sauer, J. (2017). Reaction kinetics and equilibrium parameters for the production of oxymethylene dimethyl ethers (OME) from methanol and formaldehyde. Chemical engineering science, 163, 92–104. doi:10.1016/j.ces.2016.12.037
Dahmen, N.; Abeln, J.; Eberhard, M.; Kolb, T.; Leibold, H.; Sauer, J.; Stapf, D.; Zimmerlin, B. (2017). The bioliq process for producing synthetic transportation fuels. Wiley interdisciplinary reviews / Energy and Environment, 6 (3), Article no e236. doi:10.1002/wene.236
Rodriguez Correa, C.; Otto, T.; Kruse, A. (2017). Influence of the biomass components on the pore formation of activated carbon. Biomass and bioenergy, 97, 53–64. doi:10.1016/j.biombioe.2016.12.017
Dietrich, C.; Schild, D.; Wang, W.; Kübel, C.; Behrens, S. (2017). Bimetallic Pt/Sn-based Nanoparticles in Ionic Liquids as Nanocatalysts for the Selective Hydrogenation of Cinnamaldehyde. Zeitschrift für anorganische und allgemeine Chemie, 643 (1), 120–129. doi:10.1002/zaac.201600391
Meller, C.; Bremer, J.; Ankit, K.; Baur, S.; Bergfeldt, T.; Blum, P.; Canic, T.; Eiche, E.; Gaucher, E.; Hagenmeyer, V.; Heberling, F.; Held, S.; Herfurth, S.; Isele, J.; Kling, T.; Kuhn, D.; Mayer, D.; Müller, B.; Nestler, B.; Neumann, T.; Nitschke, F.; Nothstein, A.; Nusiaputra, Y.; Orywall, P.; Peters, M.; Sahara, D.; Schäfer, T.; Schill, E.; Schilling, F.; Schröder, E.; Selzer, M.; Stoll, M.; Wiemer, H.-J.; Wolf, S.; Zimmermann, M.; Kohl, T. (2017). Integrated Research as Key to the Development of a Sustainable Geothermal Energy Technology. Energy technology, 5 (7), 965–1006. doi:10.1002/ente.201600579
Funke, A.; Henrich, E.; Dahmen, N.; Sauer, J. (2017). Dimensional Analysis of Auger-Type Fast Pyrolysis Reactors. Energy technology, 5 (1), 119–129. doi:10.1002/ente.201600095
Kalz, K. F.; RalphKraehnert; MuslimDvoyashkin; Dittmeyer, R.; Gläser, R.; Krewer, U.; Reuter, K.; Grunwaldt, J.-D. (2017). Future Challenges in Heterogeneous Catalysis : Understanding Catalysts under Dynamic Reaction Conditions. ChemCatChem, 9 (1), 17–29. doi:10.1002/cctc.201600996
Miao, D.; Cavusoglu, G.; Lichtenberg, H.; Yu, J.; Xu, H.; Grunwaldt, J.-D.; Goldbach, A. (2017). Water-gas shift reaction over platinum/strontium apatite catalysts. Applied catalysis / B, 202, 587–596. doi:10.1016/j.apcatb.2016.09.059
Funke, A. (2017). Comparison of intermediate and fast pyrolysis in screw-type reactors. PyNe Newsletter, (41), 3–5.
Kannepalli, S.; Bürger, A.; Tischer, S.; Deutschmann, O. (2017). Model-Based Optimization of Ammonia Dosing in NH₃-SCR of NOₓ for Transient Driving Cycle : Model Development and Simulation. Emission control science and technology, 3 (4), 249–262. doi:10.1007/s40825-017-0072-4
Schuler, J.; Hornung, U.; Kruse, A.; Dahmen, N.; Sauer, J. (2017). Hydrothermal Liquefaction of Lignin. Journal of biomaterials and nanobiotechnology, 08 (01), 96–108. doi:10.4236/jbnb.2017.81007
2016
Book Chapters
Kruse, A. (2016). Supercritical Water Gasification for Biomass-Based Hydrogen Production. Hydrogen Science and Engineering : Materials, Processes, Systems and Technology. Ed. D. Stolten, 109–129, Wiley-VCH Verlag. doi:10.1002/9783527674268.ch06
Journal Articles
Ille, Y.; Hamberger, P.; Dahmen, N.; Schaber, K. (2016). Heat and Mass Transfer during Condensation of Fast Pyrolysis Vapors. Chemie - Ingenieur - Technik, 88 (9), 1235. doi:10.1002/cite.201650162
Feng, P.; Lin, W.; Jensen, P. A.; Song, W.; Hao, L.; Raffelt, K.; Dam-Johansen, K. (2016). Entrained flow gasification of coal/bio-oil slurries. Energy, 111 (Sept 15), 793–802. doi:10.1016/j.energy.2016.05.115
Hettel, M.; Antinori, C.; Deutschmann, O. (2016). CFD Evaluation of In Situ Probe Techniques for Catalytic Honeycomb Monoliths. Emission control science and technology, 2 (4), 188–203. doi:10.1007/s40825-016-0043-1
Cavusoglu, G.; Dallmann, F.; Lichtenberg, H.; Goldbach, A.; Dittmeyer, R.; Grunwaldt, J.-D. (2016). In situ characterization of catalysts and membranes in a microchannel under high-temperature water gas shift reaction conditions. Journal of physics / Conference Series, 712 (1), Art. Nr.: 012054. doi:10.1088/1742-6596/712/1/012054
Cavusoglu, G.; Lichtenberg, H.; Gaur, A.; Goldbach, A.; Grunwaldt, J.-D. (2016). Flame made ceria supported noble metal catalysts for efficient H₂ production via the water gas shift reaction. Journal of physics / Conference Series, 712 (1), Art. Nr.: 012065. doi:10.1088/1742-6596/712/1/012065
Günter, T.; Doronkin, D. E.; Carvalho, H. W. P.; Casapu, M.; Grunwaldt, J.-D. (2016). HERFD-XANES and XES as complementary operando tools for monitoring the structure of Cu-based zeolite catalysts during NOx-removal by ammonia SCR. Journal of physics / Conference Series, 712 (1), Art. Nr.: 012071. doi:10.1088/1742-6596/712/1/012071
Doronkin, D. E.; Baier, S.; Sheppard, T.; Benzi, F.; Grunwaldt, J.-D. (2016). Lithographically fabricated silicon microreactor for operando QEXAFS studies in exhaust gas catalysis during simulation of a standard driving cycle. Journal of physics / Conference Series, 712 (1), Art. Nr.: 012030. doi:10.1088/1742-6596/712/1/012030
Hofmann, G.; Tofighi, G.; Rinke, G.; Baier, S.; Ewinger, A.; Urban, A.; Wenka, A.; Heideker, S.; Jahn, A.; Dittmeyer, R.; Grunwaldt, J.-D. (2016). A Microfluidic Device for the Investigation of Rapid Gold Nanoparticle Formation in Continuous Turbulent Flow. Journal of physics / Conference Series, 712 (1), Art. Nr.: 012072. doi:10.1088/1742-6596/712/1/012072
Gänzler, A. M.; Lichtenberg, H.; Frenkel, A. I.; Casapu, M.; Boubnov, A.; Wang, D.; Grunwaldt, J.-D. (2016). Using combined XAS/DRIFTS to study CO/NO Oxidation over Pt/Al2O3 catalysts. Journal of physics / Conference Series, 712 (1), Art. Nr.: 012045. doi:10.1088/1742-6596/712/1/012045
Olbrich, W.; Boscagli, C.; Raffelt, K.; Zang, H.; Dahmen, N.; Sauer, J. (2016). Catalytic hydrodeoxygenation of pyrolysis oil over nickel-based catalysts under H2/CO2 atmosphere. Sustainable Chemical Processes, 4 (1), 9. doi:10.1186/s40508-016-0053-x
Zhao, Z.-J.; Kulkarni, A.; Vilella, L.; Nørskov, J. K.; Studt, F. (2016). Theoretical Insights into the Selective Oxidation of Methane to Methanol in Copper-Exchanged Mordenite. ACS catalysis, 6 (6), 3760–3766. doi:10.1021/acscatal.6b00440
Dörsam, S.; Kirchhoff, J.; Bigalke, M.; Dahmen, N.; Syldatk, C.; Ochsenreither, K. (2016). Evaluation of Pyrolysis Oil as Carbon Source for Fungal Fermentation. Frontiers in microbiology, 7, Art.Nr. 2059. doi:10.3389/fmicb.2016.02059
Bujnowski, K.; Synoradzki, L.; Darłak, R. C.; Zevaco, T. A.; Dinjus, E. (2016). Semi-synthetic zwitterionic rifamycins: A promising class of antibiotics; Survey of their chemistry and biological activities. RSC Advances, 6 (115), 114758–114772. doi:10.1039/c6ra22880a
To, J. W. F.; Ng, J. W. D.; Siahrostami, S.; Koh, A. L.; Lee, Y.; Chen, Z.; Fong, K. D.; Chen, S.; He, J.; Bae, W.-G.; Wilcox, J.; Jeong, H. Y.; Kim, K.; Studt, F.; Nørskov, J. K.; Jaramillo, T. F.; Bao, Z. (2016). High-performance oxygen reduction and evolution carbon catalysis: From mechanistic studies to device integration. Nano research, 10 (4), 1163–1177. doi:10.1007/s12274-016-1347-8
Burger, J.; Hasse, H.; Härtl, M.; Wachtmeister, G.; Arnold, U.; Sauer, J. (2016). Oxymethylene Dimethyl Ethers (OMEs) : Alternative Diesel Fuels for Low-Emission Combustion. Chemie - Ingenieur - Technik, 88 (9), 1259. doi:10.1002/cite.201650368
Dahmen, N.; Hornung, U.; Schuler, J.; Schmiedl, D.; Rohde, V. (2016). Bifunktionelle Synthesebausteine durch hydrothermale Verflüssigung von Organosolv-Lignin. Chemie - Ingenieur - Technik, 88 (9), 1412. doi:10.1002/cite.201650501
Mutz, B.; Carvalho, H. W. P.; Kleist, W.; Grunwaldt, J.-D. (2016). Dynamic transformation of small Ni particles during methanation of CO under fluctuating reaction conditions monitored by X-ray absorption spectroscopy. Journal of physics / Conference Series, 712, 012050. doi:10.1088/1742-6596/712/1/012050
Karakaya, C.; Karadeniz, H.; Maier, L.; Deutschmann, O. (2016). Surface reaction kinetics of the oxidation and reforming of propane over Rh/Al₂O₃ catalysts. ChemCatChem, 9 (4), 685–695. doi:10.1002/cctc.201601237
Lautenschütz, L.; Oestreich, D.; Seidenspinner, P.; Arnold, U.; Dinjus, E.; Sauer, J. (2016). Physico-chemical properties and fuel characteristics of oxymethylene dialkyl ethers. Fuel, 173, 129–137. doi:10.1016/j.fuel.2016.01.060
Bär, J.; Antinori, C.; Maier, L.; Deutschmann, O. (2016). Spatial Concentration Profiles for the Catalytic Partial Oxidation of Jet Fuel Surrogates in a Rh/Al₂O₃ Coated Monolith. Catalysts, 6 (12), Art. Nr.: 207. doi:10.3390/catal6120207
Rink, J.; Mozaffari, B.; Tischer, S.; Deutschmann, O.; Votsmeier, M. (2016). Real-time Simulation of Dual-Layer Catalytic Converters Based on the Internal Mass Transfer Coefficient Approach. Topics in catalysis, 60 (3-5), 225–229. doi:10.1007/s11244-016-0602-2
May, K.; Eremin, A.; Stannarius, R.; Szabó, B.; Börzsönyi, T.; Appel, I.; Behrens, S.; Klein, S. (2016). Exceptionally large magneto-optical response in dispersions of plate-like nanocrystallites and magnetic nanoparticles. Journal of magnetism and magnetic materials, 431, 79–83. doi:10.1016/j.jmmm.2016.07.053
Appel, I.; Behrens, S. (2016). Influence of the particle parameters on the stability of magnetic dopants in a ferrolyotropic suspension. Journal of magnetism and magnetic materials, 431, 49–53. doi:10.1016/j.jmmm.2016.09.053
Aljama, H.; Yoo, J. S.; Nørskov, J. K.; Abild-Pedersen, F.; Studt, F. (2016). Methanol Partial Oxidation on Ag(1 1 1) from First Principles. ChemCatChem, 8 (23), 3621–3625. doi:10.1002/cctc.201601053
Mortensen, P. M.; Grunwaldt, J.-D.; Jensen, P. A.; Jensen, A. D. (2016). Influence on nickel particle size on the hydrodeoxygenation of phenol over Ni/SiO2. Catalysis today, 259 (2), 277–284. doi:10.1016/j.cattod.2015.08.022
Doronkin, D. E.; Kuriganova, A. B.; Leontyev, I. N.; Baier, S.; Lichtenberg, H.; Smirnova, N. V.; Grunwaldt, J.-D. (2016). Electrochemically Synthesized Pt/Al₂O₃ Oxidation Catalysts. Catalysis letters, 146 (1), 452–463. doi:10.1007/s10562-015-1651-z
Sheppard, T.; Daly, H.; Goguet, A.; Thompson, J. M. (2016). Improved Efficiency for Partial Oxidation of Methane by Controlled Copper Deposition on Surface-Modified ZSM-5. ChemCatChem, 8 (3), 560–570. doi:10.1002/cctc.201500980
Woo, M.; Choi, B. C.; Ghoniem, A. F. (2016). Experimental and numerical studies on NOx emission characteristics in laminar non-premixed jet flames of ammonia-containing methane fuel with oxygen/nitrogen oxidizer. Energy, 114, 961–972. doi:10.1016/j.energy.2016.07.150
Plessow, P. N.; Abild-Pedersen, F. (2016). Sintering of Pt Nanoparticles via Volatile PtO2: Simulation and Comparison with Experiments. ACS catalysis, 6 (10), 7098–7108. doi:10.1021/acscatal.6b01646
Stotz, H.; Maier, L.; Deutschmann, O. (2016). Methane Oxidation over Palladium : On the Mechanism in Fuel-Rich Mixtures at High Temperatures. Topics in catalysis, 60 (1-2), 83–109. doi:10.1007/s11244-016-0717-5
Karakaya, C.; Maier, L.; Deutschmann, O. (2016). Surface Reaction Kinetics of the Oxidation and Reforming of CH₄ over Rh/Al₂O₃ Catalysts. International journal of chemical kinetics, 48 (3), 144–160. doi:10.1002/kin.20980
Pfitzer, C.; Dahmen, N.; Tröger, N.; Weirich, F.; Sauer, J.; Günther, A.; Müller-Hagedorn, M. (2016). Fast Pyrolysis of Wheat Straw in the Bioliq Pilot Plant. Energy & Fuels / Special Issue, 30 (10), 8047–8054. doi:10.1021/acs.energyfuels.6b01412
Kruse, A.; Koch, F.; Stelzl, K.; Wüst, D.; Zeller, M. (2016). Fate of Nitrogen during Hydrothermal Carbonization. Energy & fuels preprints, 2016 (30), 8037–8042. doi:10.1021/acs.energyfuels.6b01312
Siahrostami, S.; Tsai, C.; Karamad, M.; Koitz, R.; García-Melchor, M.; Bajdich, M.; Vojvodic, A.; Abild-Pedersen, F.; Nørskov, J. K.; Studt, F. (2016). Two-Dimensional Materials as Catalysts for Energy Conversion. Catalysis letters, 146 (10), 1917–1921. doi:10.1007/s10562-016-1837-z
Kulkarni, A. R.; Zhao, Z.-J.; Siahrostami, S.; Nørskov, J. K.; Studt, F. (2016). Monocopper Active Site for Partial Methane Oxidation in Cu-Exchanged 8MR Zeolites. ACS catalysis, 6 (10), 6531–6536. doi:10.1021/acscatal.6b01895
Zhou, Y.; Doronkin, D. E.; Chen, M.; Wei, S.; Grunwaldt, J.-D. (2016). Interplay of Pt and Crystal Facets of TiO₂: CO Oxidation Activity and Operando XAS/DRIFTS Studies. ACS catalysis, 6, 7799–7809. doi:10.1021/acscatal.6b01509
Garcia-Pintos, D.; Voss, J.; Jensen, A. D.; Studt, F. (2016). Hydrodeoxygenation of Phenol to Benzene and Cyclohexane on Rh(111) and Rh(211) Surfaces: Insights from Density Functional Theory. The journal of physical chemistry <Washington, DC> / C, 120 (33), 18529–18537. doi:10.1021/acs.jpcc.6b02970
Rai, R. K.; Gupta, K.; Tyagi, D.; Mahata, A.; Behrens, S.; Yang, X.; Xu, Q.; Pathak, B.; Singh, S. K. (2016). Access to highly active Ni-Pd bimetallic nanoparticle catalysts for C-C coupling reactions. Catalysis science & technology, 6 (14), 5567–5579. doi:10.1039/c6cy00037a
Zimina, A.; Dardenne, K.; Denecke, M. A.; Grunwaldt, J. D.; Huttel, E.; Lichtenberg, H.; Mangold, S.; Pruessmann, T.; Rothe, J.; Steininger, R.; Vitova, T. (2016). The CAT-ACT Beamline at ANKA : A new high energy X-ray spectroscopy facility for CATalysis and ACTinide research. Journal of physics / Conference Series, 712 (1), Art. Nr. 012019. doi:10.1088/1742-6596/712/1/012019
Günter, T.; Doronkin, D. E.; Boubnov, A.; Carvalho, H. W. P.; Casapu, M.; Grunwaldt, J.-D. (2016). The SCR of NOx with NH3 Examined by Novel X-ray Emission and X-ray Absorption Methods. Topics in catalysis, 59 (10-12), 866–874. doi:10.1007/s11244-016-0561-7
Zhang, X.; Oyedun, A. O.; Kumar, A.; Oestreich, D.; Arnold, U.; Sauer, J. (2016). An optimized process design for oxymethylene ether production from woody-biomass-derived syngas. Biomass and bioenergy, 90, 7–14. doi:10.1016/j.biombioe.2016.03.032
Funke, A.; Richter, D.; Niebel, A.; Dahmen, N.; Sauer, J. (2016). Fast pyrolysis of biomass residues in a twin-screw mixing reactor. Journal of visualized experiments, (115), e54395. doi:10.3791/54395
Suwelack, K.; Wüst, D.; Zeller, M.; Kruse, A.; Krümpel, J. (2016). Hydrothermal carbonization of wheat straw - prediction of product mass yields and degree of carbonization by severity parameter. Biomass Conversion and Biorefinery, 6 (3), 347–354. doi:10.1007/s13399-015-0192-4
Grunwaldt, J.-D.; Hagelstein, M.; Rothe, J. (2016). The 16th International Conference on X-ray Absorption Fine Structure (XAFS16). Journal of physics / Conference Series, 712 (1), 011001. doi:10.1088/1742-6596/712/1/011001
Grunwaldt, H. S.; Zimina, A.; Göttlicher, J.; Steininger, R.; Grunwaldt, J.-D. (2016). Study of the relation between Mg content and dissolution kinetics of natural lime stone using μxRF, μxRD and μxAS. Journal of physics / Conference Series, 712 (1), 012144. doi:10.1088/1742-6596/712/1/012144
Boubnov, A.; Roppertz, A.; Kundrat, M. D.; Mangold, S.; Reznik, B.; Jacob, C. R.; Kureti, S.; Grunwaldt, J.-D. (2016). Towards advanced structural analysis of iron oxide clusters on the surface of γ-Al2O3 using EXAFS. Applied surface science, 386, 234–246. doi:10.1016/j.apsusc.2016.05.148
Rischard, J.; Antinori, C.; Deutschmann, O. (2016). Oxidative dehydrogenation of a C4-raffinate 2 towards 1,3-butadiene in a two-zonbe fluidized bed reactor using a Mo-V-MgO catalyst. Chemie - Ingenieur - Technik, 88 (11), 1723–1729. doi:10.1002/cite.201600055
Rischard, J.; Franz, R.; Antinori, C.; Deutschmann, O. (2016). Oxidative dehydrogenation of butenes over Bi-Mo and Mo-V based catalysts in a two-zone fluidized bed reactor. AIChE journal, 63 (1), 43–50. doi:10.1002/aic.15368
Bär, J. N.; Rocha, M. I.; De Oliveira, E. J.; Deutschmann, O. (2016). Impact of sulfur on catalytic partial oxidation of jet fuel surrogates over Rh/Al₂O₃. International journal of hydrogen energy, 41 (5), 3701–3711. doi:10.1016/j.ijhydene.2015.12.015
Baier, S.; Damsgaard, C. D.; Scholz, M.; Benzi, F.; Rochet, A.; Hoppe, R.; Scherer, T.; Shi, J.; Wittstock, A.; Weinhausen, B.; Wagner, J. B.; Schroer, C. G.; Grunwaldt, J.-D. (2016). In Situ Ptychography of Heterogeneous Catalysts using Hard X-Rays: High Resolution Imaging at Ambient Pressure and Elevated Temperature. Microscopy and microanalysis, 22 (1), 178–188. doi:10.1017/S1431927615015573
Cai, X.; Wörner, M.; Marschall, H.; Deutschmann, O. (2016). Numerical study on the wettability dependent interaction of a rising bubble with a periodic open cellular structure. Catalysis today, 273, 151–160. doi:10.1016/j.cattod.2016.03.053
Ahmad, R.; Arnold, U.; Deutsch, D.; Döring, M.; Sauer, J. (2016). Passivation and reactivation of catalyst systems for the single step synthesis of dimethyl ether from CO-rich synthesis gas. Journal of molecular catalysis / A, 422, 207–215. doi:10.1016/j.molcata.2015.12.029
Schöttle, C.; Doronkin, D. E.; Popescu, R.; Gerthsen, D.; Grunwaldt, J.-D.; Feldmann, C. (2016). Ti⁰ nanoparticles via lithium-naphthalenide-driven reduction. Chemical communications, 52 (37), 6316–6319. doi:10.1039/c6cc01957a
Lopez Barreiro, D.; Gomez, B. R.; Ronsse, F.; Hornung, U.; Kruse, A.; Prins, W. (2016). Heterogeneous catalytic upgrading of biocrude oil produced by hydrothermal liquefaction of microalgae: State of the art and own experiments. Fuel Processing Technology, 148, 117–127. doi:10.1016/j.fuproc.2016.02.034
Gmeiner, J.; Seibicke, M.; Behrens, S.; Spliethoff, B.; Trapp, O. (2016). Investigation of the Hydrogenation of 5-Methylfurfural by Noble Metal Nanoparticles in a Microcapillary Reactor. ChemSusChem, 9 (6), 583–587. doi:10.1002/cssc.201600045
Gmeiner, J.; Behrens, S.; Spliethoff, B.; Trapp, O. (2016). Ruthenium Nanoparticles in High-Throughput Studies of Chemoselective Carbonyl Hydrogenation Reactions. ChemCatChem, 8 (3), 571–576. doi:10.1002/cctc.201501069
Behrens, S.; Appel, I. (2016). Magnetic nanocomposites. Current opinion in biotechnology, 39, 89–96. doi:10.1016/j.copbio.2016.02.005
Zimina, A.; Vilfan, I.; Vrbanic, D.; Nicolosi, V.; Batchelor, D.; Steininger, R.; Mihailovic, D. (2016). Electronic structure of purified Mo₆S(₉ ₋ ₓ)Iₓnanowires studied by X-ray spectroscopy. Journal of electron spectroscopy and related phenomena, 207, 29–33. doi:10.1016/j.elspec.2015.12.004
Elsayed, S.; Boukis, N.; Patzelt, D.; Hindersin, S.; Kerner, M.; Sauer, J. (2016). Gasification of Microalgae Using Supercritical Water and the Potential of Effluent Recycling. Chemical Engineering and Technology, 39 (2), 335–342. doi:10.1002/ceat.201500146
Falconi, C. J.; Lehrenfeld, C.; Marschall, H.; Meyer, C.; Abiev, R.; Bothe, D.; Reusken, A.; Schlüter, M.; Wörner, M. (2016). Numerical and experimental analysis of local flow phenomena in laminar Taylor flow in a square mini-channel. Physics of Fluids, 28 (1), 012109. doi:10.1063/1.4939498
Rischard, J.; Antinori, C.; Maier, L.; Deutschmann, O. (2016). Oxidative dehydrogenation of n-butane to butadiene with Mo-V-MgO catalysts in a two-zone fluidized bed reactor. Applied catalysis / A, 511, 23–30. doi:10.1016/j.apcata.2015.11.026
Mozaffari, B.; Tischer, S.; Votsmeier, M.; Deutschmann, O. (2016). A one-dimensional modeling approach for dual-layer monolithic catalysts. Chemical Engineering Science, 139, 196–210. doi:10.1016/j.ces.2015.09.021
Schulze, M.; Mumme, J.; Funke, A.; Kern, J. (2016). Effects of selected process conditions on the stability of hydrochar in low-carbon sandy soil. Geoderma, 267, 137–145. doi:10.1016/j.geoderma.2015.12.018
Nicoleit, T.; Dahmen, N.; Sauer, J. (2016). Production and storage of gasifiable slurries based on flash-pyrolyzed straw. Energy Technology, 4, 221–229. doi:10.1002/ente.201500273
Funke, A.; Niebel, A.; Richter, D.; Abbas, M. M.; Müller, A.-K.; Radloff, S.; Paneru, M.; Maier, J.; Dahmen, N.; Sauer, J. (2016). Fast pyrolysis char - Assessment of alternative uses within the bioliq® concept. Bioresource Technology, 200, 905–913. doi:10.1016/j.biortech.2015.11.012
Gentzen, M.; Habicht, W.; Doronkin, D. E.; Grunwaldt, J.-D.; Sauer, J.; Behrens, S. (2016). Bifunctional hybrid catalysts derived from Cu/Zn-based nanoparticles for single-step dimethyl ether synthesis. Catalysis science & technology, 6 (4), 1054–1063. doi:10.1039/c5cy01043h
Henrich, E.; Dahmen, N.; Weirich, F.; Reimert, R.; Kornmayer, C. (2016). Fast pyrolysis of lignocellulosics in a twin screw mixer reactor. Fuel Processing Technology, 143, 151–161. doi:10.1016/j.fuproc.2015.11.003
Breunig, M. (2016). Direct liquefaction of lignin and lignocellulose by catalytic hydrogenolysis. PyNe Newsletter, (39), 6–8.
Schwiderski, M.; Kruse, A. (2016). Process design and economics of an aluminium chloride catalysed organosolv process. Biomass Conversion and Biorefinery, (6), 335–345. doi:10.1007/s13399-015-0189-z
Suwelack, K.; Wüst, D.; Zeller, M.; Kruse, A.; Krümpel, J. (2016). Hydrothermal carbonization of wheat straw - prediction of product mass yields and degree of carbonization by severity parameter. Biomass Conversion and Biorefinery, (6), 347–354.
Suwelack, K.; Wüst, D.; Zeller, M.; Kruse, A.; Krümpel, J. (2016). Hydrothermal carbonization of wheat straw - prediction of product mass yields and degree of carbonization by severity parameter. Biomass Conversion and Biorefinery (2190-6815, 2190-6823), (6), 347–354. doi:10.1007/d 13399-015-0192-4
Hettel, M.; Antinori, C.; Deutschmann, O. (2016). CFD-Evaluation of in-situ probe techniques for catalytic honeycomb monoliths. Emission control science and technology, 2 (4), 188–203.
2015
Book Chapters
Dahmen, N.; Sauer, J. (2015). Synfuels via biomass gasification. Biomass Power for the World : Transformation to Effective Use. Hrsg.: W. van Swaaij, 323–339, Pan Stanford Publishing.
Hengst, K.; Schubert, M.; Kleist, W.; Grunwaldt, J. D. (2015). Hydrodeoxygenation of lignocellulase-derived platform molecules. Rindaldi, R. [Hrsg.] Catalytic Hydrogenation for Biomass Valorization Cambridge : Royal Society of Chemistry, 2015 (RSC Energy and Environment Series ; 13), 125–150.
Titirici, M. M.; Funke, A.; Kruse, A. (2015). Hydrothermal carbonization of biomass. Pandey, A. [Hrsg.] Recent Advances in Thermochemical Conversion of Biomass Amsterdam [u.a.] : Elsevier, 2015, 325–352.
Journal Articles
Schröder, J.; Arnold, U.; Abeln, J.; Sauer, J.; Döring, M. (2015). Conversion of Carbon Monoxide-Rich Synthesis Gas to Hydrocarbons and Alcohols over Cu/Co/ZnO/SiO₂ Catalysts. Chemie - Ingenieur - Technik, 87 (12), 1760–1770. doi:10.1002/cite.201400194
Joubert, J.-E.; Carrier, M.; Dahmen, N.; Stahl, R.; Knoetze, J. H. (2015). Inherent process variations between fast pyrolysis technologies: A case study on Eucalyptus grandis. Fuel processing technology, 131, 389–395. doi:10.1016/j.fuproc.2014.12.012
Sauer, J.; Klemm, E. (2015). New Tasks for the Reaction Technique. Chemie - Ingenieur - Technik, 87 (6), 667–667. doi:10.1002/cite.201590035
Weber, C.; Boscagli, C.; Raffelt, K.; Richter, D.; Zevaco, T. (2015). Fast pyrolysis of fresh bio waste and ensiled municipal green cut. Chemie - Ingenieur - Technik, 87 (12), 1696–1706. doi:10.1002/cite.201500040
Sauer, J. von. (2015). Wie verändert sich die Forschung in Reaktionstechnik und Katalyse mit der Rohstoffbasis der chemischen Industrie?. Chemie - Ingenieur - Technik, 87 (12), 1623. doi:10.1002/cite.201590094
Adolph, M.; Zevaco, T. A.; Altesleben, C.; Staudt, S.; Walter, O.; Dinjus, E. (2015). New ionic cobalt(iii) complexes based on the N,N-bis(2-pyrazinecarboxamide)-1,2-benzene ligand: Application to the formation of organic carbonates from epoxides and CO2. New Journal of Chemistry, 39 (12), 9858–9865. doi:10.1039/c5nj02135a
Bujnowski, K.; Synoradzki, L.; Zevaco, T. A.; Dinjus, E.; Augustynowicz-Kopec, E.; Napiorkowska, A. (2015). Rifamycin antibiotics-new compounds and synthetic methods. Part 4: Study of the reaction of 3-formylrifamycin SV with secondary amines and ketones. Tetrahedron, 71 (1), 158–169. doi:10.1016/j.tet2014.10.079
Adolph, M.; Zevaco, T. A.; Altesleben, C.; Staudt, S.; Dinjus, E. (2015). New zinc catalysts based on easy-to-handle N4-chelating ligands for the coupling reaction of epoxides with CO2. Journal of Molecular Catalysis A: Chemical, 400, 104–110. doi:10.1016/j.molcata.2015.01.028
Sheikhdavoodi, M. J.; Almassi, M.; Ebrahimi-Nik, M.; Kruse, A.; Bahrami, H. (2015). Gasification of sugarcane bagasse in supercritical water; Evaluation of alkali catalysts for maximum hydrogen production. Journal of the Energy Institute, 88 (4), 450–458. doi:10.1016/j.joei.2014.10.005
Boscagli, C.; Raffelt, K.; Zevaco, T. A.; Olbrich, W.; Otto, T. N.; Sauer, J.; Grunwaldt, J.-D. (2015). Mild hydrotreatment of the light fraction of fast-pyrolysis oil produced from straw over nickel-based catalysts. Biomass and bioenergy, 83, 525–538. doi:10.1016/j.biombioe.2015.11.003
Henrich, E.; Dahmen, N.; Dinjus, E.; Sauer, J. (2015). The role of biomass in a future world without fossil fuels. Chemie-Ingenieur-Technik, 87 (12), 1667–1685. doi:10.1002/cite.201500056
Patzelt, D. J.; Hindersin, S.; Elsayed, S.; Boukis, N.; Kerner, M.; Hanelt, D. (2015). Hydrothermal gasification of Acutodesmus obliquus for renewable energy production and nutrient recycling of microalgal mass cultures. Journal of applied phycology, 27 (6), 2239–2250. doi:10.1007/s10811-014-0496-y
Ding, W.; Klumpp, M.; Lee, S.; Reuß, S.; Al-Thabaiti, S. A.; Pfeifer, P.; Schwieger, W.; Dittmeyer, R. (2015). Simulation of one-stage dimethyl ether synthesis over a core-shell catalyst. Chemie - Ingenieur - Technik, 87 (6), 702–712. doi:10.1002/cite.201400157
Möbius, A.; Boukis, N.; Hindersin, S.; Kerner, M. (2015). Cultivation and hydrothermal gasification of microalgae scenedesmus obliquus-first experimental results. Chemie - Ingenieur - Technik, 87 (12), 1720–1725. doi:10.1002/cite.201500002
Nicoleit, T.; Haßel, A.; Niebel, A.; Sauer, J. (2015). Partikelform und Porosität von biogenen Pyrolysekoksen. Chemie - Ingenieur - Technik, 87 (12), 1733–1740. doi:10.1002/cite.201500027
Gotthardt, M. A.; Grosjean, S.; Brunner, T. S.; Kotzel, J.; Gänzler, A. M.; Wolf, S.; Bräse, S.; Kleist, W. (2015). Synthesis and post-synthetic modification of amine-, alkyne-, azide- and nitro-functionalized metal-organic frameworks based on DUT-5. Dalton transactions, 44 (38), 16802–16809. doi:10.1039/c5dt02276b
Tepluchin, M.; Kureti, S.; Casapu, M.; Ogel, E.; Mangold, S.; Grunwaldt, J. D. (2015). Study on the hydrothermal and SO₂ stability of Al₂O₃-supported manganese and iron oxide catalysts for lean CO oxidation. Catalysis today, 258, 498–506. doi:10.1016/j.cattod.2015.01.010
Teoh, Q. Y.; Doronkin, D. E.; Beh, G. K.; Dreyer, J. A. H.; Grunwaldt, J. D. (2015). Methanation of carbon monoxide over promoted flame-synthesized cobalt clusters stabilized in zirconia matrix. Journal of catalysis, 326, 182–193. doi:10.1016/j.jcat.2015.03.014
Hellinger, M.; Pereira de Carvalho, H. W.; Baier, S.; Gharnati, L.; Grunwaldt, J. D. (2015). Solvent influence on the hydrodeoxygenation of guaiacol over Pt/SiO₂ and Pt/H-MFI90 catalysts. Chemie - Ingenieur - Technik, 87 (12), 1771–1780. doi:10.1002/cite.201500143
Karadeniz, H.; Karakaya, C.; Tischer, S.; Deutschmann, O. (2015). Mass transfer effects in stagnation flows on a porous catalyst: Water-gas-shift reaction over Rh/Al₂O₃. Zeitschrift für physikalische Chemie, 229 (5), 709–737. doi:10.1515/zpch-2014-0622
Delgado, K. H.; Maier, L.; Tischer, S.; Zellner, A.; Stotz, H.; Deutschmann, O. (2015). Surface Reaction Kinetics of Steam- and CO₂-Reforming as Well as Oxidation of Methane over Nickel-Based Catalysts. Catalysts, 5 (2), 871–904. doi:10.3390/catal5020871
Zimmermann, M.; Otto, T. N.; Powietzka, B.; Neumann-Walter, D. (2015). Umsetzung von Dimethylether zu Kraftstoffen mit hierachischen Zeolithkatalysatoren. Chemie - Ingenieur - Technik, 12, 1748–1759. doi:10.1002/cite.201500042
Hettel, M.; Diehm, C.; Bonart, H.; Deutschmann, O. (2015). Numerical simulation of a structured catalytic methane reformer by DUO: The new computational interface for OpenFOAM and DETCHEM. Catalysis today, 258, 230–240. doi:10.1016/j.cattod.2015.02.011
Kruse, A.; Kirchherr, M.; Gaag, S.; Zevaco, T. A. (2015). Hydrothermale Karbonisierung 4. Thermische Eigenschaften der Produkte. Chemie - Ingenieur - Technik, 87 (12), 1707–1712. doi:10.1002/cite.201500039
Günter, T.; Carvalho, H. W. P.; Doronkin, D. E.; Sheppard, T.; Glatzel, P.; Atkins, A. J.; Rudolph, J.; Jacob, C. R.; Casapu, M.; Grunwaldt, J. D. (2015). Structural snapshots of the SCR reaction mechanism on Cu-SSZ-13. Chemical communications, 51, 9227–9230. doi:10.1039/C5CC01758K
Gänzler, A. M.; Casapu, M.; Boubnov, A.; Müller, O.; Conrad, S.; Lichtenberg, H.; Frahm, R.; Grunwaldt, J. D. (2015). Operando spatially and time-resolved X-ray absorption spectroscopy and infrared thermography during oscillatory CO oxidation. Journal of catalysis, 328, 216–224. doi:10.1016/j.jcat.2015.01.002
Baier, S.; Rochet, A.; Hofmann, G.; Kraut, M.; Grunwaldt, J. D. (2015). Lithographically fabricated silicon microreactor for in situ characterization of heterogeneous catalysts-Enabling correlative characterization techniques. Review of scientific instruments, 86, 065101/1–9. doi:10.1063/1.4921775
Cavusoglu, G.; Miao, D.; Lichtenberg, H.; Carvalho, H. W. P.; Xu, H.; Goldbach, A.; Grunwaldt, J. D. (2015). Structure and activity of flame made ceria supported Rh and Pt water gas shift catalysts. Applied catalysis / A, 504, 381–390. doi:10.1016/j.apcata.2015.01.047
Boubnov, A.; Lichtenberg, H.; Mangold, S.; Grunwaldt, J. D. (2015). Identification of the iron oxidation state and coordination geometry in iron oxide- and zeolite-based catalysts using pre-edge XAS analysis. Journal of synchrotron radiation, 22, 410–426. doi:10.1107/S1600577514025880
Lee, S.; Schneider, K.; Schumann, J.; Mogalicherla, A. K.; Pfeifer, P.; Dittmeyer, R. (2015). Effect of metal precursor on Cu/ZnO/Al₂O₃ synthesized by flame spray pyrolysis for direct DME production. Chemical engineering science, 138, 194–202. doi:10.1016/j.ces.2015.08.021
Essig, S.; Behrens, S. (2015). Ionic liquids as size- and shape-regulating solvents for the synthesis of cobalt nanoparticles. Chemie - Ingenieur - Technik, 87 (12), 1741–1747. doi:10.1002/cite.201500036
López Barreiro, D.; Bauer, M.; Hornung, U.; Posten, C.; Kruse, A.; Prins, W. (2015). Cultivation of microalgae with recovered nutrients after hydrothermal liquefaction. Algal Research, 9, 99–106. doi:10.1016/j.algal.2015.03.007
Funke, A. (2015). Fate of plant available nutrients during hydrothermal carbonization of digestate. Chemie - Ingenieur - Technik, 87 (12), 1713–1719. doi:10.1002/cite.201400182
Lopez Barreiro, D.; Rios Gomez, B.; Hornung, U.; Kruse, A.; Prins, W. (2015). Hydrothermal liquefaction of microalgae in a continuous stirred-tank reactor. Energy & fuels, 29 (10), 6422–6432. doi:10.1021/acs.energyfuels.5b02099
Rai, R. K.; Gupta, K.; Behrens, S.; Li, J.; Xu, Q.; Singh, S. K. (2015). Highly active bimetallic nickel-palladium alloy nanoparticle catalyzed Suzuki-Miyaura reactions. ChemCatChem, 7, 1806–1812. doi:10.1002/cctc.201500145
Hengst, K.; Schubert, M.; Carvalho, H. W. P.; Lu, C.; Kleist, W.; Grunwaldt, J. D. (2015). Synthesis of γ-valerolactone by hydrogenation of levulinic acid over supported nickel catalysts. Applied catalysis / A, 502, 18–26. doi:10.1016/j.apcata.2015.05.007
Cai, X.; Marschall, H.; Wörner, M.; Deutschmann, O. (2015). Numerical simulation of wetting phenomena with a phase-field method using OpenFOAM. Chemical engineering & technology, 38 (11), 1985–1992. doi:10.1002/ceat.201500089
Eßmann, C.; Maier, L.; Li, A.; Tischer, S.; Deutschmann, O. (2015). Natural gas steam reforming over rhodium/alumina catalysts: Experimental and numerical study of the carbon deposition from ethylene and carbon monoxide. Industrial & engineering chemistry research, 53 (31), 12270–12278. doi:10.1021/ie5015525
Lopez Barreiro, D.; Riede, S.; Hornung, U.; Kruse, A.; Prins, W. (2015). Hydrothermal liquefaction of microalgae : Effect on the product yields of the addition of an organic solvent to separate the aqueous phase and the biocrude oil. Algal Research, 12, 206–212. doi:10.1016/j.algal.2015.08.025
Schuh, K.; Kleist, W.; Hoj, M.; Trouillet, V.; Beato, P.; Jensen, A. D.; Grunwaldt, J. D. (2015). Bismuth molybdate catalysts prepared by mild hydrothermal synthesis: Influence of pH on the selective oxidation of propylene. Catalysts, 5, 1554–1573. doi:10.3390/catal5031554
Mutz, B.; Carvalho, H. W. P.; Mangold, S.; Kleist, W.; Grunwaldt, J. D. (2015). Methanation of CO₂ : Structural response of a Ni-based catalyst under fluctuating reaction conditions unraveled by operando spectroscopy. Journal of catalysis, 327, 48–53. doi:10.1016/j.jcat.2015.04.006
Kunz, L.; Kuhn, F. M.; Deutschmann, O. (2015). Kinetic Monte Carlo simulations of surface rections on supported nanoparticles : A novel approach and computer code. The journal of chemical physics, 143 (4), Art. Nr. 044108. doi:10.1063/1.4926924
Hammerschmidt, A.; Boukis, N.; Galla, U.; Zevaco, T.; DInjus, E.; Hitzmann, B. (2015). Influence of the heating rate and the potassium concentration of the feed solution on the hydrothermal liquefactioin of used yeast and apple pomace under reducing conditions. Biomass Conversion and Biorefinery, 5 (2), 125–139. doi:10.1007/s13399-014-0148-0
Schuh, K.; Kleist, W.; Hoej, M.; Jensen, A. D.; Beato, P.; Patzke, G. R.; Grunwaldt, J. D. (2015). Systematic study on the influence of the morphology of α-MoO₃ in the selective oxidation of propylene. Journal of solid state chemistry, 228, 42–52. doi:10.1016/j.jssc.2015.04.011
Patzelt, D.; Hindersin, S.; Elsayed, S.; Boukis, N.; Kerner, M.; Hanelt, D. (2015). Microalgal growth and fatty acid productivity on recovered nutrients from hydrothermal gasification of Acutodesmus obliquus. Algal Research, 10, 164–171. doi:10.1016/j.algal.2015.05.002
Lopez Barreiro, D.; Beck, M.; Hornung, U.; Ronsse, F.; Kruse, A.; Prins, W. (2015). Suitability of hydrothermal liquefaction as a conversion route to produce biofuels from macroalgae. Algal Research, 11, 234–241. doi:10.1016/j.algal.2015.06.023
Schwiderski, M.; Kruse, A. (2015). Aluminiumchlorid-katalysierter Organosolv-Aufschluss von Buchenholz. Chemie - Ingenieur - Technik, 87, 922–830. doi:10.1002/cite.201400096
Hellinger, M.; Baier, S.; Mortensen, P. M.; Kleist, W.; Jensen, A. D.; Grunwaldt, J.-D. (2015). Continuous catalytic hydrodeoxygenation of guaiacol over Pt/SiO₂ and Pt/H-MFI-90. Catalysts, 5 (3), 1152–1166. doi:10.3390/catal5031152
Kruse, A.; Grandl, R. (2015). Hydrothermale Karbonisierung: 3. Kinetisches Modell. Chemie - Ingenieur - Technik, 87 (4), 449–456. doi:10.1002/cite.201400116
Dittmeyer, R.; Grunwaldt, J.-D.; Pashkova, A. (2015). A review of catalyst performance and novel reaction engineering concepts in direct synthesis of hydrogen peroxide. Catalysis today, 248, 149–159. doi:10.1016/j.cattod.2014.03.055
Schwiderski, M.; Kruse, A. (2015). Catalytic effect of aluminium chloride on the example of the conversion of sugar model compounds. Journal of molecular catalysis / A, 402, 64–70. doi:10.1016/j.molcata.2015.03.018
Jasinski, N.; Lauer, A.; Stals, P. J. M.; Behrens, S.; Essig, S.; Walther, A.; Goldmann, A. S.; Barner-Kowollik, C. (2015). Cleaning the click: A simple electrochemical avenue for copper removal from strongly coordinating macromolecules. ACS Macro Letters, 4 (3), 298–301. doi:10.1021/acsmacrolett.5b00046
Zellner, A.; Suntz, R.; Deutschmann, O. (2015). Two-dimensional spatial resolution of concentration profiles in catalytic reactors by planar laser-induced fluorescence: No reduction over diesel oxidation catalysts. Angewandte Chemie, 127, 2691–2693. doi:10.1002/ange.201410324
Zellner, A.; Suntz, R.; Deutschmann, O. (2015). Two-dimensional spatial resolution of concentration profiles in catalytic reactors by planar laser-induced fluorescence: No reduction over diesel oxidation catalysts. Angewandte Chemie / International edition, 54, 2653–2655. doi:10.1002/anie.201410324
Walter, K. M.; Schubert, M.; Kleist, W.; Grunwaldt, J. D. (2015). Effect of the addition of ethanol to synthesis gas on the production of higher alcohols over Cs and Ru modified Cu/ZnO catalysts. Industrial & engineering chemistry research, 54, 1452–1463. doi:10.1021/ie504066f
Arnold, U.; Altesleben, C.; Behrens, S.; Essig, S.; Lautenschütz, L.; Schild, D.; Sauer, J. (2015). Ionic liquid-initiated polymerization of epoxides: A useful strategy for the preparation of Pd-doped polyether catalysts. Catalysis today, 246, 116–124. doi:10.1016/j.cattod.2014.08.026
Hellinger, M.; Carvalho, H. W. P.; Baier, S.; Wang, D.; Kleist, W.; Grunwaldt, D. (2015). Catalytic hydrodeoxygenation of guaiacol over platinum supported on metal oxides and zeolites. Applied catalysis / A, 490, 181–192. doi:10.1016/j.apcata.2014.10.043
Wörner, M. (2015). General pure convection residence time distribution theory of fully development laminar flows in straight planar and axisymmetric channels. Chemical engineering science, 122, 555–564. doi:10.1016/j.ces.2014.10.015
Gotthardt, M. A.; Schoch, R.; Brunner, T. S.; Bauer, M.; Kleist, W. (2015). Design of highly porous single-site catalysts through two-step postsynthetic modification of mixed-linker MIL-53(Al). ChemPlusChem, 80, 188–195. doi:10.1002/cplu.201402123
Gotthardt, M. A.; Schoch, R.; Wolf, S.; Bauer, M.; Kleist, W. (2015). Synthesis and characterization of bimetallic metal-organic framework Cu-Ru-BTC with HKUST-1 structure. Dalton transactions, 44, 2052–2056. doi:10.1039/C4DT02491E
Dahmen, N.; Arnold, U.; Djordjevic, N.; Henrich, T.; Kolb, T.; Leibold, H.; Sauer, J. (2015). High pressure in synthetic fuels production. The journal of supercritical fluids, 96, 124–132. doi:10.1016/j.supflu.2014.09.031
Castello, D.; Kruse, A.; Fiori, L. (2015). Low temperature supercritical water gasification of biomass constituents: Glucose/phenol mixtures. Biomass and bioenergy, 73, 84–94. doi:10.1016/j.biombioe.2014.12.010
Kruse, A.; Dahmen, N. (2015). Water - a magic solvent for biomass conversion. The journal of supercritical fluids, 96, 36–45. doi:10.1016/j.supflu.2014.09.038
Funke, A.; Richter, D.; Niebel, A.; Dahmen, N.; Sauer, J. (2015). Betriebserfahrung mit Schnellpyrolyse von Stroh im Technikumsmaßstab: Zwei Strategien zur Produktabscheidung im direkten Vergleich. Erdöl, Erdgas, Kohle, 131, 23–26.
Dahmen, N.; Sauer, J. (2015). Benzin aus Stroh. Chemie & More, (3), 18–21.
Dahmen, N.; Sauer, J. (2015). Aus Stroh mach Benzin. Spektrum der Wissenschaft, (4), 11–13.
2014
Book Chapters
Hornung, U.; Kruse, A.; Gkagül, G. (2014). Hydrothermal liquefaction - upgrading. Hornung, A. [Hrsg.] Transformation of Biomass : Theory to Practice Chichester : John Wiley & Sons, Ltd., 2014, 175–187.
Journal Articles
Fuchs, M.; Zevaco, T.; Dinjus, E.; Walter, O. (2014). Catena-poly[[aquazinc(II)]-μ-N,N′-bis(2-cyano-3-ethoxy-3-oxoprop- 1-enyl)benzene-1,2-diaminido]. Acta crystallographica / E, 70 (5), m187–m188. doi:10.1107/S1600536814008381
Fuchs, M. A.; Altesleben, C.; Staudt, S. C.; Walter, O.; Zevaco, T. A.; Dinjus, E. (2014). New air-stable zinc complexes formed from cyanoacrylate- and methylenemalonate-based [N₂O₂]-ligands and their role as catalysts in epoxide–CO₂ coupling. Catalysis science & technology, 4 (6), Article no: 1658. doi:10.1039/c4cy00125g
Fuchs, M. A.; Staudt, S.; Altesleben, C.; Walter, O.; Zevaco, T. A.; Dinjus, E. (2014). A new air-stable zinc complex based on a 1,2-phenylene-diimino-2- cyanoacrylate ligand as an efficient catalyst of the epoxide-CO₂ coupling. Dalton transactions, 43 (6), 2344–2347. doi:10.1039/C3DT52927D
Adolph, M.; Zevaco, T. A.; Altesleben, C.; Walter, O.; Dinjus, E. (2014). New cobalt, iron and chromium catalysts based on easy-to-handle N₄-chelating ligands for the coupling reaction of epoxides with CO₂. Dalton transactions, 43 (8), 3285–3296. doi:10.1039/C3DT53084A
Boubnov, A.; Carvalho, H. W. P.; Doronkin, D. E.; Günter, T.; Gallo, E.; Atkins, A. J.; Jacob, C. R.; Grunwaldt, J.-D. (2014). Selective Catalytic Reduction of NO Over Fe-ZSM-5: Mechanistic Insights by Operando HERFD-XANES and Valence-to-Core X-ray Emission Spectroscopy. Journal of the American Chemical Society, 136 (37), 13006–13015. doi:10.1021/ja5062505
Hauck, C.; Tischer, S.; Maier, L.; Deutschmann, O. (2014). Modelling of local aging effects of commercial three-way catalysts: Spatial temperature and CO conversion profiles. The Canadian journal of chemical engineering, 92 (9), 1587–1596. doi:10.1002/cjce.22027
Ding, W.; Li, H.; Pfeifer, P.; Dittmeyer, R. (2014). Crystallite-pore network model of transport and reaction of multicomponent gas mixtures in polycrystalline microporous media. The chemical engineering journal, 254, 545–558. doi:10.1016/j.cej.2014.05.081
Chan, D.; Tischer, S.; Heck, J.; Diehm, C.; Deutschmann, O. (2014). Correlation between catalytic activity and catalytic surface area of a Pt/Al₂O₃ DOC: An experimental and microkinetic modeling study. Applied Catalysis B, 156-157, 153–165. doi:10.1016/j.apcatb.2014.03.009
Zellner, A.; Suntz, R.; Deutschmann, O. (2014). In-situ-Untersuchungen katalytischer NO-Reduktion in einem optisch zugänglichen Strömungskanal. Chemie - Ingenieur - Technik, 86, 538–543. doi:10.1002/cite.201300140
Karakaya, C.; Otterstätter, R.; Maier, L.; Deutschmann, O. (2014). Kinetics of the water-gas shift reaction over Rh/Al2O 3 catalysts. Applied catalysis / A, 470, 31–44. doi:10.1016/j.apcata.2013.10.030
Zhang, X.; Kumar, A.; Arnold, U.; Sauer, J. (2014). Biomass-derived oxymethylene ethers as diesel additives: A thermodynamic analysis. Energy procedia, 61, 1921–1924. doi:10.1016/j.egypro.2014.12.242
Ahmad, R.; Hellinger, M.; Buchholz, M.; Sezen, H.; Gharnati, L.; Wöll, C.; Sauer, J.; Döring, M.; Grunwaldt, J.-D.; Arnold, U. (2014). Flame-made Cu/ZnO/Al₂O₃ catalyst for dimethyl ether production. Catalysis communications, 43, 52–56. doi:10.1016/j.catcom.2013.08.020
Tepluchin, M.; Casapu, M.; Boubnov, A.; Lichtenberg, H.; Wang, D.; Kureti, S.; Grunwaldt, J.-D. (2014). Fe and Mn-Based catalysts supported on γ-Al₂O₃ for CO oxidation under O₂-rich conditions. ChemCatChem, 6 (6), 1763–1773. doi:10.1002/cctc.201301040
Schwiderski, M.; Kruse, A.; Grandl, R.; Dockendorf, D. (2014). Kinetics of the AlCl₃ catalyzed xylan hydrolysis during Methanosolv pulping of beech wood. RSC Advances, 4 (85), 45118–45127. doi:10.1039/C4RA05554C
Baldizzone, C.; Mezzavilla, S.; Carvalho, H. W. P.; Meier, J. C.; Schuppert, A. K.; Heggen, M.; Galeano, C.; Grunwaldt, J.-D.; Schüth, F.; Mayrhofer, K. J. J. (2014). Confined-space alloying of nanoparticles for the synthesis of efficient PtNi fuel-cell catalysts. Angewandte Chemie / International edition, 53 (51), 14250–14254. doi:10.1002/anie.201406812
Marschall, H.; Boden, S.; Lehrenfeld, C.; Falconi, C. J.; Hampel, U.; Reusken, A.; Wörner, M.; Bothe, D. (2014). Validation of interface capturing and tracking techniques with different surface tension treatments against a Taylor bubble benchmark problem. Computers and Fluids, 102, 336–352. doi:10.1016/j.compfluid.2014.06.030
Katzir, E.; Yochelis, S.; Zeides, F.; Katz, N.; Behrens, S.; Kalcheim, Y.; Millo, O.; Paltiel, Y. (2014). Increasing the critical temperature of Nb films by chemically linking magnetic nanoparticles using organic molecules. epl, 108, 37006/p1-p6. doi:10.1209/0295-5075/108/37006
Forchheim, D.; Hornung, U.; Kruse, A.; Sutter, T. (2014). Kinetic modelling of hydrothermal lignin depolymerisation. Waste and biomass valorization, 5, 985–994. doi:10.1007/s12649-014-9307-6
Lopez Barreiro, D.; Samori, C.; Terranella, G.; Hornung, U.; Kruse, A.; Prins, W. (2014). Assessing microalgae biorefinery routes for the production of biofuels via hydrothermal liquefaction. Bioresource technology, 174, 256–265. doi:10.1016/j.biortech.2014.10.031
Schuh, K.; Kleist, W.; Hoej, M.; Trouillet, V.; Jensen, A. D.; Grunwaldt, J. D. (2014). One-step synthesis of bismuth molybdate catalysts via flame spray pyrolysis for the selective oxidation of propylene to acrolein. Chemical communications, 50 (97), 15404–15406. doi:10.1039/C4CC07527G
Castello, D.; Kruse, A.; Fiori, L. (2014). Supercritical water gasification of hydrochar. Chemical engineering research and design, 92, 1864–1875. doi:10.1016/j.cherd.2014.05.024
Schuh, K.; Kleist, W.; Hoej, M.; Trouillet, V.; Beato, P.; Jensen, A. D.; Patzke, G. R.; Grunwaldt, J. D. (2014). Selective oxidation of propylene to acrolein by hydrothermally synthesized bismuth molybdates. Applied catalysis / A, 482 (Jul 22), 145–156. doi:10.1016/j.apcata.2014.05.038
Boeltken, T.; Soysal, D.; Lee, S.; Straczewski, G.; Gerhards, U.; Pfeifer, P.; Arnold, J.; Dittmeyer, R. (2014). Perspectives of suspension plasma spraying of palladium nanoparticles for preparation of thin palladium composite membranes. Journal of membrane science, 468, 233–241. doi:10.1016/j.memsci.2014.06.003
Girke, F. P. (2014). In-line determination of the water content of pyrolysis oils. PyNe Newsletter, 34, 5 S.
Ahmad, R.; Schrempp, D.; Behrens, S.; Sauer, J.; Döring, M.; Arnold, U. (2014). Zeolite-based bifuntional catalysts for the single step synthesis of dimethyl ether from CO-rich synthesis gas. Fuel processing technology, 121, 38–46. doi:10.1016/j.fuproc.2014.01.006
Schwiderski, M.; Kruse, A.; Grandl, R.; Dockendorf, D. (2014). Comparison of the influence of a Lewis acid AlCl₃ and a Broensted acid HCl on the organosolv pulping of beech wood. Green chemistry, 16, 1569–1578. doi:10.1039/C3GC42050G
Bargmann, I.; Rillig, M. C.; Kruse, A.; Greef, J. M.; Kücke, M. (2014). Initial and subsequent effects of hydrochar amendment on germination and nitrogen uptake of spring barley. Journal of plant nutrition and soil science, 177, 68–74. doi:10.1002/jpln.201300160
Bargmann, I.; Martens, R.; Rillig, M. C.; Kruse, A.; Kücke, M. (2014). Hydrochar amendment promotes microbial immobilization of mineral nitrogen. Journal of plant nutrition and soil science, 177, 59–67. doi:10.1002/jpln.201300154
Hudry, D.; Griveau, J. C.; Apostolidis, C.; Walter, O.; Colineau, E.; Rasmussen, G.; Wang, D.; Chakravadhanula, V. S. K.; Courtois, E.; Kübel, C.; Meyer, D. (2014). Thorium/uranium mixed oxide nanocrystals: synthesis, structural characterization and magnetic properties. Nano research, 7 (1), 119–131. doi:10.1007/s12274-013-0379-6
Kläusli, T. M.; Kruse, A. (2014). Innovationsprojekt: Biomasse zu Kunststoff. Das KIT und die AVA Biochem haben gemeinsam ein Verfahren entwickelt, um aus Biomasse eine Plattformchemikalie für die Kunststoffproduktion herzustellen. Research to Business, (3), 2–3.
2013
Book Chapters
Sauer, J.; Dahmen, N.; Henrich, E. (2013). Tubular Plug Flow Reactors. Ullmann’s Encyclopedia of Industrial Chemistry., 1–23, Wiley-VCH Verlag. doi:10.1002/14356007.b04_181.pub2
Schroer, C. G.; Grunwaldt, J.-D. (2013). Spatially Resolved X-ray Absorption Spectroscopy. In-situ Characterization of Heterogeneous Catalysts. Ed.: Rodriguez, J.A, 49–74, John Wiley and Sons. doi:10.1002/9781118355923.ch2
Möbius, A.; Boukis, N.; Sauer, J. (2013). Gasification of biomass in supercritical water (SCWG). Mendez-Vilas, A. [Hrsg.] Materials and Processes for Energy : Communicating Current Research and Technological Developments Badajoz : Formatex Research Center, 2013 (Energy Book Series ; # 1), 264–268.
Kruse, A.; Baris, D.; Tröger, N.; Wieczorek, P. (2013). Scale-up in hydrothermal carbonization. Titirici, M.M. [Hrsg.] Sustainable Carbon Materials from Hydrothermal Processes New York, N.Y. : Wiley, 2013. doi:10.1002/9781118622179.ch9
Grunwaldt, J. D. (2013). In situ analysis of heterogeneous catalysts in chemical energy conversion. Chemical Energy Storage. Hrsg.: R. Schlögl, 311–328, Walter de Gruyter.
Journal Articles
Singh, S. K.; Yadav, M.; Behrens, S.; Roesky, P. W. (2013). Au-based bimetallic nanoparticles for the intramolecular aminoalkene hydroamination. Dalton Transactions, 42 (29), 10404–10408. doi:10.1039/c3dt50652e
Bhunia, A.; Gotthardt, M. A.; Yadav, M.; Gamer, M. T.; Eichhöfer, A.; Kleist, W.; Roesky, P. W. (2013). Salen-based coordination polymers of manganese and the rare-earth elements: Synthesis and catalytic aerobic epoxidation of olefins. Chemistry - A European Journal, 19 (6), 1986–1995. doi:10.1002/chem.201203636
Deutschmann, O.; Grunwaldt, J.-D. (2013). Abgasnachbehandlung in mobilen Systemen : Stand der Technik, Herausforderungen und Perspektiven [Exhaust Gas Aftertreatment in Mobile Systems: Status, Challenges, and Perspectives]. Chemie - Ingenieur - Technik, 85 (5), 595–617. doi:10.1002/cite.201200188
Boubnov, A.; Gänzler, A.; Conrad, S.; Casapu, M.; Grunwaldt, J.-D. (2013). Oscillatory CO oxidation over Pt/Al₂O₃ catalysts studied by in situ XAS and DRIFTS. Topics in catalysis, 56 (1-8), 333–338. doi:10.1007/s11244-013-9976-6
Boubnov, A.; Lichtenberg, H.; Mangold, S.; Grunwaldt, J.-D. (2013). Structure and reducibility of a Fe/Al₂O₃ catalyst for selective catalytic reduction studied by Fe K-edge XAFS spectroscopy. Journal of physics / Conference Series, 430 (1), 012054/1–4. doi:10.1088/1742-6596/430/1/012054
Høj, M.; Jensen, A. D.; Grunwaldt, J.-D. (2013). Structure of alumina supported vanadia catalysts for oxidative dehydrogenation of propane prepared by flame spray pyrolysis. Applied catalysis / A, 451, 207–215. doi:10.1016/j.apcata.2012.09.037
Grunwaldt, J.-D.; Wagner, J. B.; Dunin-Borkowski, R. E. (2013). Imaging Catalysts at Work: A Hierarchical Approach from the Macro- to the Meso- and Nano-scale. ChemCatChem, 5 (1), 62–80. doi:10.1002/cctc.201200356
Gharnati, L.; Musko, N. E.; Jensen, A. D.; Kontogeorgis, G. M.; Grunwaldt, J.-D. (2013). Fluid phase equilibria during propylene carbonate synthesis from propylene oxide in carbon dioxide medium. The journal of supercritical fluids, 82, 106–115. doi:10.1016/j.supflu.2013.04.008
Tsivintzelis, I.; Musko, N. E.; Baiker, A.; Grunwaldt, J.-D.; Kontogeorgis, G. M. (2013). Experimental determination and modeling of the phase behavior for the direct synthesis of dimethyl carbonate from methanol and carbon dioxide. The journal of supercritical fluids, 84, 155–163. doi:10.1016/j.supflu.2013.09.020
Trippe, F.; Fröhling, M.; Schultmann, F.; Stahl, R.; Henrich, E.; Dalai, A. (2013). Comprehensive techno-economic assessment of dimethyl ether (DME) synthesis and Fischer-Tropsch synthesis as alternative process steps within biomass-to-liquid production. Fuel Processing Technology, 106, 577–586. doi:10.1016/j.fuproc.2012.09.029
Haro, P.; Trippe, F.; Stahl, R.; Henrich, E. (2013). Bio-syngas to gasoline and olefins via DME - A comprehensive techno-economic assessment. Applied Energy, 108, 54–65. doi:10.1016/j.apenergy.2013.03.015
Günter, T.; Casapu, M.; Doronkin, D.; Mangold, S.; Trouillet, V.; Augenstein, T.; Grunwaldt, J.-D. (2013). Potential and limitations of natural chabazite for selective catalytic reduction of NOₓ with NH₃. Chemie - Ingenieur - Technik, 85 (5), 632–641. doi:10.1002/cite.201200182
Müller, P.; Bykov, Y.; Döring, M. (2013). New star-shaped phosphorus-containing flame retardants based on acrylates for epoxy resins. Polymers for Advanced Technologies, 24, 834–840. doi:10.1002/pat.3151
Walter, O. (2013). 1-(5,5-Dimethoxypentyl)-3-methyl-imidazolium-2-carboxylate. Acta Crystallographica E, 69, o1611. doi:10.1107/S1600536813027013
Deutsch, D.; Zevaco, T.; Walter, O. (2013). Bis(dimethyl sulfoxide-κO)tetrakis(μ₂-3,4,5-trimethoxybenzoato-κ²O:O’)-dizinc. Acta Crystallographica E, 69, m519. doi:10.1107/S1600536813023118
Tolonen, L. K.; Penttilä, P. A.; Serimaa, R.; Kruse, A.; Sixta, H. (2013). The swelling and dissolution of cellulose crystallites in subcritical and supercritical water. Cellulose, 20, 2731–2744. doi:10.1007/s10570-013-0072-7
Piras, E.; Powietzka, B.; Wurst, F.; Neumann-Walter, D.; Grützmacher, H. J.; Otto, T.; Zevaco, T.; Walter, O. (2013). Highly active hydroformylation catalysts: Synthesis, characterisation and catalytic performance. Catalysis Letters, 143, 673–680. doi:10.1007/s10562-013-1010-x
Bargmann, I.; Rillig, M. C.; Buss, W.; Kruse, A.; Kuecke, M. (2013). Hydrochar and biochar effects on germination of spring barley. Journal of Agronomy and Crop Science, 199, 360–373. doi:10.1111/jac.12024
Eibisch, N.; Helfrich, M.; Don, A.; Mikutta, R.; Kruse, A.; Ellerbrock, R.; Flessa, H. (2013). Properties and degradability of hydrothermal carbonization products. Journal of Environmental Quality, 42, 1565–1573. doi:10.2134/jeq2013.02.0045
Yanik, J.; Stahl, R.; Troeger, N.; Sinag, A. (2013). Pyrolysis of algal biomass. Journal of Analytical and Applied Pyrolysis, 103, 134–141. doi:10.1016/j.jaap.2012.08.016
Gotthardt, M. A.; Beilmann, A.; Schoch, R.; Engelke, J.; Kleist, W. (2013). Post-synthetic immobilization of palladium complexes on metal-organic frameworks. A new concept for the design of heterogeneous catalysts for Heck reactions. RSC Advances, 3, 10676–10679. doi:10.1039/C3RA42105H
Funke, A.; Reebs, F.; Kruse, A. (2013). Experimental comparison of hydrothermal and vapothermal carbonization. Fuel Processing Technology, 115, 261–269. doi:10.1016/j.fuproc.2013.04.020
Wörner, M.; Erdogan, S. (2013). Toward improved closure relations for the turbulent kinetic energy equation in bubble-driven flows. Chemie - Ingenieur - Technik, 85 (7), 1131–1136. doi:10.1002/cite.201200243
Kruse, A.; Funke, A.; Titirici, M. M. (2013). Hydrothermal conversion of biomass to fuels and energetic materials. Curent Opinion in Chemical Biology, 17, 515–521. doi:10.1016/j.cbpa.2013.05.004
Castello, D.; Kruse, A.; Fiori, L. (2013). Biomass gasification in supercritical and subcritical water: The effect of the reactor material. Chemical Engineering Journal, 228, 535–544. doi:10.1016/j.cej.2013.04.119
Wörner, M. (2013). Computational study on scaling of co-current downward Taylor flow in small square channels of three different sizes. Journal of chemical engineering of Japan, 46 (5), 335–341. doi:10.1252/jcej.12we068
Fuchs, M. A.; Zevaco, T. A.; Ember, E.; Walter, O.; Held, I.; Dinjus, E.; Döring, M. (2013). Synthesis of cyclic carbonates from epoxides and carbon dioxide catalyzed by an easy-to-handle ionic iron(III) complex. Dalton Transactions, 42, 5322–5329. doi:10.1039/c3dt32961e
Sypien, J. K.; Zevaco, T. A.; Flicker, A.; Walter, O.; Dinjus, E. (2013). New aluminum 2,2’-methylenebis(4-chloro-3-methyl-6-(isopropyl)phenoxides): Structural characterization of an unusual ionic aluminum bisphenoxide [Al(THF)₄(Cl)₂]⁺[Al(mcmip)₂]⁻.x THF. Inorganic Chemistry Communications, 30, 69–73. doi:10.1016/j.inoche.2013.01.021
Tröger, N.; Kröger, M.; Richter, D.; Förster, S.; Schröder, J.; Zech, K.; Liemen, F.; Stahl, R.; Müller-Langer, F. (2013). Utilization of biogenic residues and wastes in thermochemical systems for the production of fuels: current status of the project. Biofuels, Bioproducts and Biorefining (Biofpr), 7 (1), 12–23. doi:10.1002/bbb.1371
Tröger, N.; Richter, D.; Stahl, R. (2013). Effect of feedstock composition on product yields and energy recovery rates of fast pyrolysis products from different straw types. Journal of Analytical and Applied Pyrolysis, 100, 158–165. doi:10.1016/j.jaap.2012.12.012
Behrens, S.; Dinjus, E.; Essig, S.; Gorschinski, A.; Habicht, W. (2013). Design and FESEM/EDX investigation of functional magnetic nanocomposite particles. Surface and Interface Analysis, 45, 705–714. doi:10.1002/sia.5145
Apostolidis, C.; Walter, O. (2013). Catena-poly [[tris(acetonitrile-κΝ)-praseodymium(III)]tris(μ-trifluoro-methanesulfonato-κ²O:O’)]. Acta crystallographica / Section E, 69 (Part 1), m21. doi:10.1107/S1600536812049525
Chakinala, A. G.; Kumar, S.; Kruse, A.; Kersten, S. R. A.; Swaaij, W. P. M. van; Brilman, D. W. F. (2013). Supercritical water gasification of organic acids and alcohols: The effect of chain length. Journal of Supercritical Fluids, 74, 8–21. doi:10.1016/j.supflu.2012.11.013
Akgül, G.; Kruse, A. (2013). Hydrothermal disproportionation of formaldehyde at subcritical conditions. Journal of Supercritical Fluids, 73, 43–50. doi:10.1016/j.supflu.2012.11.007
Raffelt, K. (2013). NMR methods for product quality diagnostics in bio-oil production. PyNe Newsletter, (33), 21–23.
Niebel, A. (2013). BioBoost : biomass based energy intermediates boosting bio-fuel production. PyNe Newsletter, (33), 14–15.
Otto, T. N.; Fuhrer, M.; Ullrich, G.; Powietzka, B.; Neumann-Walter, D. (2013). Erzeugung von Flüssigargon in kleinen Mengen für die Anwendung im Labor. GIT Fachzeitschrift für das Laboratorium, (2), 108–110.
2012
Book Chapters
Kruse, A.; Vogel, F.; Bennekom, J. van; Venderbosch, R. (2012). Biomass gasification in supercritical water. Knoef, H.A.M. [Hrsg.] Handbook Biomass Gasification - Second Edition Enschede : BTG Biomass Technology Group BV, 2012, 251–280.
Dahmen, N.; Kruse, A. (2012). High pressure in renewable energy processes. Eggers, R. [Hrsg.] Industrial High Pressure Applications : Processes, Equipment and Safety Weinheim : Wiley-VCH, 2012, 235–256.
Otto, T. N.; Habicht, W.; Dinjus, E.; Zimmermann, M. (2012). Catalyst characterization with FESEM/EDX by the example of silver-catalyzed epoxidation of 1,3-butadiene. Scanning Electron Microscopy. Ed.: Viacheslav Kazmiruk, 367–392, InTech. doi:10.5772/37952
Kruse, A.; Dinjus, E. (2012). Sub- and supercritical water. Kobayashi, S. [Hrsg.] Water in Organic Synthesis Stuttgart [u.a.] : Thieme, 2012 (Science of Synthesis : SOS ; 2011,7), 749–771.
Journal Articles
Dahmen, N.; Dinjus, E.; Kolb, T.; Arnold, U.; Leibold, H.; Stahl, R. (2012). State of the art of the bioliq® process for synthetic biofuels production. Environmental progress & sustainable energy, 31 (2), 176–181. doi:10.1002/ep.10624
Wagner, S.; Rakotomalala, M.; Chesneau, F.; Zevaco, T.; Döring, M. (2012). Spectral assignment of phenanthrene derivatives based on 6H-dibenzo[C,E][1,2] oxaphosphinine 6-Oxide by NMR and quantum chemical calculations. Phosphorus, sulfur and silicon & the related elements, 187 (7), 781–798. doi:10.1080/10426507.2011.610848
Müller, P.; Bykov, Y.; Walter, O.; Döring, M. (2012). New phosphorus-containing quinone derivatives. Heteroatom Chemistry, 23, 383–394. doi:10.1002/hc.21028
Bykov, Y.; Wagner, S.; Walter, O.; Döring, M.; Fischer, O.; Pospiech, D.; Köppl, T.; Altstädt, V. (2012). Synthesis of new dibenzo[c.e][1,2]oxaphosphorine 2-oxide containing diols based on diethanolamine. Heteroatom Chemistry, 23, 146–153. doi:10.1002/hc.20763
Möbius, A.; Boukis, N.; Galla, U.; Dinjus, E. (2012). Gasification of pyroligneous acid in supercritical water. Fuel, 94, 395–400. doi:10.1016/j.fuel.2011.11.023
Bujnowski, K.; Synoradzki, L.; Zevaco, T.; Dinjus, E. (2012). Rifamycin antibiotics - new compounds and synthetic methods: Part 3: Study of the reaction of 3-formylrifamycin SV with primary amines and ketones. Tetrahedron, 68 (29), 5925–5934. doi:10.1016/j.tet.2012.04.071
Adolph, M.; Zevaco, T. A.; Walter, O.; Dinjus, E.; Döring, M. (2012). Easy-to-handle ionic transition metal complexes in the formation of carbonates from epoxides and CO₂: A N₄-ligand system based on N,N-bis(2-pyridinecarboxamide)-1,2-benzene. Polyhedron, 48 (1), 92–98. doi:10.1016/j.poly.2012.09.011
Fendt, A.; Streibel, T.; Sklorz, M.; Richter, D.; Dahmen, N.; Zimmermann, R. (2012). On-line process analysis of biomass flash pyrolysis gases enabled by soft photoionization mass spectrometry. Energy & Fuels, 26, 701–711. doi:10.1021/ef2012613
Apostolidis, C.; Ahlmann, M.; Walter, O. (2012). fac-bromidotricarbonyl[2-(diisopropylphosphanyl)benzaldehyde-κ²O,P]-rhenium(I). Acta Crystallographica E, 68, m1201/1–6. doi:10.1107/S1600536812035957
Turba, S.; Foxon, S. P.; Beitat, A.; Heinemann, F. W.; Petukhov, K.; Müller, P.; Walter, O.; Lloret, F.; Julve, M.; Schindler, S. (2012). Syntheses, characterization, and magnetic studies of copper(II) complexes with the ligand N,N,N’,N’ - tetrakis(2-pyridylmethyl)-1,3-benzenediamine (1,3-tpbd) and its phenol derivative 2,6-bis[bis(2-pyridylmethyl)amino]-p-cresol] (2,6-Htpcd). Inorganic Chemistry, 51, 88–97. doi:10.1021/ic201051g
Prikhod’ko, A.; Walter, O.; Zevaco, T. A.; Garcia-Rodriguez, J.; Mouhtady, O.; Py, S. (2012). Synthesis of α-amino acids through samarium(II) iodide promoted reductive coupling of nitrones with CO₂. European Journal of Organic Chemistry, 3742–3746. doi:10.1002/ejoc.201200440
Boubnov, A.; Dahl, S.; Johnson, E.; Puig Molina, A.; Bredmose Simonsen, S.; Morales Cano, F.; Helveg, S.; Lemus-Yegres, L. J.; Grunwaldt, J.-D. (2012). Structure-activity relationships of Pt/Al₂O₃ catalysts for CO and NO oxidation at diesel exhaust conditions. Applied catalysis / B, 126 (25), 315–325. doi:10.1016/j.apcatb.2012.07.029
Musko, N. E.; Jensen, A. D.; Baiker, A.; Kontogeorgis, G. M.; Grunwaldt, J. D. (2012). Fluid phase equilibria of the reaction mixture during the selective hydrogenation of 2-butenal in dense carbon dioxide. Applied catalysis / A, 443-444, 67–75. doi:10.1016/j.apcata.2012.07.027
Karakaya, C.; Deutschmann, O. (2012). A simple method for CO chemisorption studies under continuous flow: Adsorption and desorption behavior of Pt/Al₂O₃ catalysts. Applied Catalysis A: General, 445-446, 221–230. doi:10.1016/j.apcata.2012.08.022
Forchheim, D.; Gasson, J. R.; Hornung, U.; Kruse, A.; Barth, T. (2012). Modeling the lignin degradation kinetics in a ethanol/formic acid solvolysis approach. Part 2. Validation and transfer to variable conditions. Industrial and Engineering Chemistry Research, 51, 15053–15063. doi:10.1021/ie3026407
Gasson, J. R.; Forchheim, D.; Sutter, T.; Hornung, U.; Kruse, A.; Barth, T. (2012). Modeling the lignin degradation kinetics in an ethanol/formic acid solvolysis approach. Part 1. Kinetic model development. Industrial and Engineering Chemistry Research, 51, 10595–10606. doi:10.1021/ie301487v
Sinag, A.; Kruse, A.; Maniam, P. (2012). Hydrothermal conversion of biomass and different model compounds. Journal of Supercritical Fluids, 71, 80–85. doi:10.1016/j.supflu.2012.07.010
Becker, P.; Schröder, J.; Ahmad, R.; Zimmermann, M.; Otto, T.; Döring, M.; Arnold, U. (2012). Recent patents on the conversion of biomass to fuels via synthesis gas. Recent Patents on Chemical Engineering, 5, 75–86.
Akgül, G.; Kruse, A. (2012). Influence of salts on the subcritical water-gas shift reaction. Journal of Supercritical Fluids, 66, 207–214. doi:10.1016/j.supflu.2011.10.009
Behrens, S.; Essig, S. (2012). A facile procedure for magnetic fluids using room temperature ionic liquids. Journal of Materials Chemistry, 22, 3811–3816. doi:10.1039/C2JM14681A
Dahmen, N.; Henrich, E.; Dinjus, E.; Weirich, F. (2012). The bioliq bioslurry gasification process for the production of biosynfuels, organic chemicals, and energy. Energy, Sustainability and Society, 2, 3. doi:10.1186/2192-0567-2-3
Kruse, A.; Badoux, F.; Grandl, R.; Wüst, D. (2012). Hydrothermale Karbonisierung: 2. Kinetik der Biertreber-Umwandlung. Chemie Ingenieur Technik, 84 (4), 509–512. doi:10.1002/cite.201100168
Forchheim, D.; Hornung, U.; Kempe, P.; Kruse, A.; Steinbach, D. (2012). Influence of RANEY nickel on the formation of intermediates in the degradation of lignin. International journal of chemical engineering, 2012, Article ID: 589749. doi:10.1155/2012/589749
Beier, M. J.; Kleist, W.; Wharmby, M. T.; Kissner, R.; Kimmerle, B.; Wright, P. A.; Grunwaldt, J. D.; Baiker, A. (2012). Aerobic Epoxidation of Olefins Catalyzed by the Cobalt-Based Metal-Organic Framework STA-12(Co). Chemistry - a European journal, 18 (3), 887–898. doi:10.1002/chem.201101223
2011
Book Chapters
Häber, T.; Kleinermanns, K. (2011). Multiphoton Resonance Spectroscopy of Biological Molecules. Handbook of high-resolution spectroscopy. Ed.: M. Quack, John Wiley and Sons. doi:10.1002/9780470749593.hrs094
Arnold, U. (2011). KIT DME/Gasoline process from biomass. DME Handbook Supplement Tokyo : Japan DME Forum, 2011, 48–50.
Journal Articles
Biemann, L.; Häber, T.; Maydt, D.; Schaper, K.; Kleinermanns, K. (2011). Fourier transform infrared spectroscopy of 2′-deoxycytidine aggregates in CDCl₃ solutions. The Journal of Chemical Physics, 134 (11), Article no: 115103. doi:10.1063/1.3557821
Mika, L. T.; Tuba, R.; Tóth I.; Pitter, S.; Horváth I. T. (2011). Molecular Mapping of the Catalytic Cycle of the Cobalt-Catalyzed Hydromethoxycarbonylation of 1,3-Butadiene in the Presence of Pyridine in Methanol. Organometallics, 30 (17), 4751–4764. doi:10.1021/om200617q
Rakotomalala, M.; Ciesielski, M.; Zevaco, T.; Doering, M. (2011). New Phosphacyclic Molecules and Their Application aS Flame Retardants for Epoxy Resins. Phosphorus, sulfur and silicon & the related elements, 186 (4), 989–996. doi:10.1080/10426507.2010.533395
Hammerschmidt, A.; Boukis, N.; Galla, U.; Dinjus, E.; Hitzmann, B. (2011). Conversion of yeast by hydrothermal treatment under reducing conditions. Fuel, 90 (11), 3424–3432. doi:10.1016/j.fuel.2011.06.052
Rakotomalala, M.; Wagner, S.; Zevaco, T.; Ciesielski, M.; Walter, O.; Döring, M. (2011). Synthesis and reactivity of 6H-dibenzo[c,e][1,2]oxaphosphinine 6-sulfide, a novel thiophosphacyclic molecule. Heterocycles, 83, 743–753. doi:10.3987/COM-10-12124
Vanderheiden, S.; Bulat, B.; Zevaco, T.; Jung, N.; Bräse, S. (2011). Solid phase synthesis of selectively deuterated arenes. Chemical Communications, 47, 9063–9065. doi:10.1039/C1CC12950C
Otto, T. N.; Mas, C.; Ederer, H.; Stiefel, M.; Döring, M.; Dinjus, E. (2011). Modeling of methanol synthesis based on elementary reactions. Chemical Engineering and Technology, 34, 1449–1458. doi:10.1002/ceat.201100232
Trippe, F.; Fröhling, M.; Schultmann, F.; Stahl, R.; Henrich, E. (2011). Techno-economic assessment of gasification as a process step within biomass-to-liquid (BtL) fuel and chemicals production. Fuel Processing Technology, 92 (11), 2169–2184. doi:10.1016/j.fuproc.2011.06.026
Madenoglu, T. G.; Boukis, N.; Saglam, M.; Yüksel, M. (2011). Supercritical water gasification of real biomass feedstocks in continuous flow system. International Journal of Hydrogen Energy, 36, 14408–14415. doi:10.1016/j.ijhydene.2011.08.047
Marx, S.; Kleist, W.; Baiker, A. (2011). Synthesis, structural properties, and catalytic behavior of Cu-BTC and mixed-linker Cu-BTC-PyDC in the oxidation of benzene derivatives. Journal of Catalysis, 281 (1), 76–87. doi:10.1016/j.jcat.2011.04.004
Magnani, N.; Apostolidis, C.; Morgenstern, A.; Colineau, E.; Griveau, J. C.; Bolvin, H.; Walter, O.; Caciuffo, R. (2011). Magnetic memory effect in a transuranic mononulcear complex. Angewandte Chemie - International Edition, 50, 1696–1698. doi:10.1002/anie.201006619
Reimann, S.; Stötzel, J.; Frahm, R.; Kleist, W.; Grunwaldt, J. D.; Baiker, A. (2011). Identification of the Active Species Generated from Supported Pd Catalysts in Heck Reactions: An in situ Quick Scanning EXAFS Investigation. Journal of the American Chemical Society, 133 (11), 3921–3930. doi:10.1021/ja108636u
Eßmann, C.; Weis, F.; Seipenbusch, M.; Schimmel, T.; Deutschmann, O. (2011). Coke Formation in Steam Reforming of Natural Gas over Rhodium/Alumina Catalysts: An Atomic Force Microscopy Study using the Oscillating Friction Mode. Zeitschrift für Physikalische Chemie, 225 (11-12), 1207–1224. doi:10.1524/zpch.2011.0160
Domide, D.; Walter, O.; Behrens, S.; Kaifer, E.; Himmel, H. J. (2011). Synthesis of heterobimetallic Zn/Co carbamates: single-source precursors of nanosized magnetic oxides under mild conditions. European journal of inorganic chemistry, 2011 (6), 860–867. doi:10.1002/ejic.201001095
Domide, D.; Hübner, O.; Behrens, S.; Walter, O.; Wadepohl, H.; Kaifer, E.; Himmel, H. J. (2011). Synthesis and reactivity of a new oxidation-labile heterobimetallic Mn₆Zn₂ carbamate cluster and precursor to nanosized magnetic oxide particles. European journal of inorganic chemistry, 2011 (9), 1387–1394. doi:10.1002/ejic.201100019
Behrens, S. (2011). Preparation of functional magnetic nanocomposites and hybrid materials: recent progress and future directions. Nanoscale, 3, 877–892. doi:10.1039/c0nr00634c
Dinjus, E.; Kruse, A.; Tröger, N. (2011). Hydrothermal carbonization. 1. Influence of lignin in lignocelluloses. Chemical Engineering and Technology, 34, 2037–2043. doi:10.1002/ceat.201100487
Dinjus, E.; Kruse, A.; Tröger, N. (2011). Hydrothermale Karbonisierung: 1. Einfluss des Lignins in Lignocellulosen. Chemie Ingenieur Technik, 83, 1734–1741. doi:10.1002/cite.201100092
Dahmen, N.; Kruse, A.; Wiegand, G.; Dinjus, E. (2011). Synthese von Hexansäure in überkritischem CO₂. Chemie Ingenieur Technik, 83, 1399–1404. doi:10.1002/cite.201100031
Kruse, A. (2011). Behandlung von Biomasse mit überkritischem Wasser. Chemie Ingenieur Technik, 83, 1381–1389. doi:10.1002/cite.201100040
Tolonen, L. K.; Zuckerstätter, G.; Penttilä, P. A.; Milacher, W.; Habicht, W.; Serimaa, R.; Kruse, A.; Sixta, H. (2011). Structural changes in microcrystalline cellulose in subcritical water treatment. Biomacromolecules, 12, 2544–2551. doi:10.1021/bm200351y
Schumacher, M.; Yanik, J.; Sinag, A.; Kruse, A. (2011). Hydrothermal conversion of seaweeds in a batch autoclave. Journal of Supercritical Fluids, 58, 131–135. doi:10.1016/j.supflu.2011.04.009
Gharnati, L.; Walter, O.; Arnold, U.; Döring, M. (2011). Guanidinium-based phosphotungstates and ionic liquids as catalysts and solvents for the epoxidation of olefins with hydrogen peroxide. European journal of inorganic chemistry, 2011 (17), 2756–2762. doi:10.1002/ejic.201100037
Otto, T. N.; Mas, C.; Ederer, H.; Stiefel, M.; Döring, M.; Dinjus, E. (2011). Modellierung der Methanolsynthese auf Basis von Elementarreaktionen. Chemie Ingenieur Technik, 83, 874–883. doi:10.1002/cite.201000199
Stiefel, M.; Ahmad, R.; Arnold, U.; Döring, M. (2011). Direct synthesis of dimethyl ether from carbon-monoxide-rich synthesis gas: influence of dehydration catalysts and operating conditions. Fuel Processing Technology, 92, 1466–1474. doi:10.1016/j.fuproc.2011.03.007
Duman, G.; Okutucu, C.; Ucar, S.; Stahl, R.; Yanik, J. (2011). The slow and fast pyrolysis of cherry seed. Bioresource Technology, 201, 1869–1878. doi:10.1016/j.biortech.2010.07.051
Habicht, W.; Boukis, N.; Hauer, E.; Dinjus, E. (2011). Analysis of hydrothermally formed corrosion layers in Ni-base alloy 625 by combined FE-SEM and EDXS. X-Ray Spectrometry, 40, 69–73. doi:10.1002/xrs.1297
Hammerschmidt, A.; Boukis, N.; Hauer, E.; Galla, U.; Dinjus, E.; Hitzmann, B.; Larsen, T.; Nygaard, S. D. (2011). Catalytic conversion of waste biomass by hydrothermal treatment. Fuel, 90, 555–562. doi:10.1016/j.fuel.2010.10.007
Sinag, A.; Yumak, T.; Balci, V.; Kruse, A. (2011). Catalytic hydrothermal conversion of cellulose over SnO₂ and ZnO nanoparticle catalysts. Journal of Supercritical Fluids, 56, 179–185. doi:10.1016/j.supflu.2011.01.002
Fröhlich, P.; Kruse, A.; Ernst, S.; Katzberg, M. (2011). Technische Chemie 2010 (Trendbericht). Nachrichten aus der Chemie, 59, 335–345. doi:10.1002/nadc.201176387
Kröger, M.; Tröger, N.; Liemen, F. (2011). Untersuchungen zur Nutzung biogener Rest- und Abfallstoffe bei der Schnellpyrolyse. Müll und Abfall, 43, 589–595.
2010
Book Chapters
Kruse, A.; Vogel, G. H. (2010). Chemistry in near- and supercritical water. Leitner, W. [Hrsg.] Handbook of Green Chemistry Vol.4: Supercritical Solvents Weinheim : Wiley VCH, 2010, 457–75.
Dahmen, N.; Henrich, E.; Kruse, A.; Raffelt, K. (2010). Biomass liquefaction and gasification. Vertes, A.A. [Hrsg.] Biomass to Biofuels : Strategies for Global Industries Chichester : Wiley, 2010, 91–122.
Journal Articles
Trippe, F.; Fröhling, M.; Schultmann, F.; Stahl, R.; Henrich, E. (2010). Techno-Economic Analysis of Fast Pyrolysis as a Process Step Within Biomass-to-Liquid Fuel Production. Waste and Biomass Valorization, 1 (4), 415–430. doi:10.1007/s12649-010-9039-1
Otto, T. N.; Dinjus, E.; Puls, A.; Hagen, V. (2010). Katalysatorcharakterisierung mit O₂-TPD, N₂- und Kr-Gassorption sowie REM am Beispiel der Epoxidierung von 1,3-Butadien. Chemie Ingenieur Technik, 82, 2215–2221.
Pufky-Heinrich, D.; Ciesielski, M.; Gharnati, L.; Walter, O.; Döring, M. (2010). Coppermediated oxidative cyclization of heterocyclically substituted aldimines. Heterocycles, 81, 1811–1825. doi:10.3987/COM-10-11966
Nebe, T.; Xu, J. Y.; Beitat, A.; Würtele, C.; Walter, O.; Serafin, M.; Schindler, S. (2010). Iron and cobalt complexes with the ligand (2-aminoethyl)bis(2-pyridyl-methyl)amine (uns-penp) and derivatives. Inorganica Chimica Acta, 363, 2965–2970. doi:10.1016/j.ica.2010.04.035
Dinjus, E.; Dahmen, N.; Kruse, A. (2010). Refining biomass into chemical energy. Przemysl Chemiczny, 88, 856–860.
Dahmen, N.; Dinjus, E. (2010). Synthetische Chemieprodukte und Kraftstoffe aus Biomasse. Chemie Ingenieur Technik, 82, 1147–1152. doi:10.1002/cite.201000082
Apostolidis, C.; Morgenstern, A.; Rebizant, J.; Kanellakopulos, B.; Walter, O.; Powietzka, B.; Karbowiak, M.; Reddmann, H.; Amberger, H. D. (2010). Zur Elektronenstruktur hochsymmetrischer Verbindungen der f-Elemente 44 [1]. Erstmalige parametrische Analyse des Absorptionsspektrums einer Molekülverbindung des trivalenten Urans: Tris[hydrotris(1-pyrazolyl)borato]uran(III). Zeitschrift für Anorganische und Allgemeine Chemie, 636, 201–208. doi:10.1002/zaac.200900271
Bönnemann, H.; Khelashvili, G. (2010). Efficient fuel cell catalysts emerging from organometallic chemistry. Applied Organometallic Chemistry, 24, 257–268. doi:10.1002/aoc.1613
Apostolidis, C.; Schimmelpfennig, B.; Magnani, N.; Lindqvist-Reis, P.; Walter, O.; Sykora, R.; Morgenstern, A.; Colineau, E.; Caciuffo, R.; Klenze, R.; Haire, R. G.; Rebizant, J.; Bruchertseifer, F.; Fanghänel, T. (2010). [An(H₂O)₉](CF₃SO₃)₃ (An=U-Cm Cf): exploring their stability, structural chemistry, and magnetic behavior by experiment and theory. Angewandte Chemie - International Edition, 49, 6343–47. doi:10.1002/anie.201001077
Sysoev, V. V.; Strelcov, E.; Sommer, M.; Bruns, M.; Kiselev, I.; Habicht, W.; Kar, S.; Gregoratti, L.; Kiskinova, M.; Kolmakov, A. (2010). Single-nanobelt electronic nose: engineering and tests of the simplest analytical element. ACS Nano, 4, 4487–94. doi:10.1021/nn100435h
Kruse, A.; Forchheim, D.; Gloede, M.; Ottinger, F.; Zimmermann, J. (2010). Brines in supercritical biomass gasification: 1.Salt extraction by salts and the influence on glucose conversion. Journal of Supercritical Fluids, 53, 64–71. doi:10.1016/j.supflu.2010.01.001
Weiss-Hortala, E.; Kruse, A.; Ceccarelli, C.; Barna, R. (2010). Influence of phenol on glucose degradation during supercritical water gasification. Journal of Supercritical Fluids, 53, 42–47. doi:10.1016/j.supflu.2010.01.004
Kruse, A.; Bernolle, P.; Dahmen, N.; Dinjus, E.; Maniam, P. (2010). Hydrothermal gasification of biomass: consecutive reactions to long-living intermediates. Energy and Environmental Science, 3, 136–43. doi:10.1039/b915034j
Dinjus, E.; Dahmen, N. (2010). Das Bioliq-Verfahren - Konzept, Technologie und Stand der Entwicklung. Motortechnische Zeitschrift, 2010 (12).
2009
Book Chapters
Dinjus, E.; Arnold, U.; Dahmen, N.; Höfer, R.; Wach, W. (2009). Green fuels - sustainable solutions for transportation. Höfer, R. [Hrsg.] Sustainable Solutions for Modern Economics Cambridge : RSC Publ., 2009 (RSC Green Chemistry Series ; 4), 125–63.
Dahmen, N.; Dinjus, E.; Kruse, A. (2009). Biomass: Thermochemical processes. Garche, J. [Hrsg.] Encyclopedia of Electrochemical Power Sources Vol.3 Amsterdam [u.a.] : Elsevier, 2009, 259–67.
Behrens, S.; Bönnemann, H.; Matoussevitch, N.; Modrow, H.; Kempter, V.; Riehemann, W.; Wiedenmann, A.; Odenbach, S.; Will, S.; Eberbeck, D.; Hergt, R.; Müller, R.; Landfester, K.; Schmidt, A.; Schüler, D.; Hempelmann, R. (2009). Synthesis and characterization. Odenbach, S. [Hrsg.] Colloidal Magnetic Fluids : Basics, Development and Application of Ferrofluids Berlin [u.a.] : Springer, 2009 (Lecture Notes in Physics ; 763), 1–82.
Journal Articles
Biemann, L.; Häber, T.; Kleinermanns, K. (2009). Fourier transform infrared spectroscopy of 1-cyclohexyluracil aggregates in CDCl₃ solutions. The Journal of Chemical Physics, 130 (12), Art.-Nr.: 125102. doi:10.1063/1.3098352
Busker, M.; Svartsov, Y. N.; Häber, T.; Kleinermanns, K. (2009). IR–UV double resonance spectra of pyrazine dimers: Competition between CH ⋯ π , π ⋯ π and CH ⋯ N interactions. Chemical Physics Letters, 467 (4-6), 255–259. doi:10.1016/j.cplett.2008.10.091
Balabanovich, A. I.; Pospiech, D.; Häußler, L.; Harnisch, C.; Döring, M. (2009). Pyrolysis behavior of phosphorus polyesters. Journal of Analytical and Applied Pyrolysis, 86, 99–107. doi:10.1016/j.jaap.2009.04.012
Padelkova, Z.; Vankatova, H.; Cisarova, I.; Nechaev, M. S.; Zevaco, T. A.; Walter, O.; Ruzicka, A. (2009). Reactivity of a C,N-chelated stannoxane. Organometallics, 28, 2629–32. doi:10.1021/om801037b
Padelkova, Z.; Nechaev, M. S.; Lycka, A.; Holubova, J.; Zevaco, T.; Ruzicka, A. (2009). Reactivity of C,N-chelated stannylene with azobenzene. European Journal of Inorganic Chemistry, (2009), 2058–61. doi:10.1002/ejic.200900181
Mieczkowski, A.; Peltier, P.; Zevaco, T.; Agrofoglio, L. A. (2009). Preparation of C5-substituted O⁶,5’-cyclouridine. Tetrahedron, 65, 4053–59. doi:10.1016/j.tet.2009.02.077
Henrich, E.; Dahmen, N.; Dinjus, E. (2009). Cost estimate for biosynfuel production via biosyncrude gasification. Biofuels, Bioproducts and Biorefining, 3, 28–41. doi:10.1002/bbb.126
Broggi, J.; Joubert, N.; Diez-Gonzalez, S.; Berteina-Raboin, S.; Zevaco, T.; Nolan, S. P.; Agrofoglio, L. A. (2009). Synthesis of (+-)-1,2,3-triazolo-3’-deoxy-4’-hydroxymethyl carbanucleosides via ’click’ cycloaddition. Tetrahedron, 65, 1162–70. doi:10.1016/j.tet.2008.11.065
Gharnati, L.; Döring, M.; Arnold, U. (2009). Catalytic oxidation with hydrogen peroxide in ionic liquids. Current Organic Synthesis, 6, 342–61. doi:10.2174/157017909789108693
Gorschinski, A.; Khelashvili, G.; Schild, D.; Habicht, W.; Brand, R.; Ghafari, M.; Bönnemann, H.; Dinjus, E.; Behrens, S. (2009). A simple aminoalkyl siloxane-mediated route to functional magnetic metal nanoparticles and magnetic nanocomposites. Journal of Materials Chemistry, 19, 8829–38. doi:10.1039/b911738e
Behrens, S.; Habicht, W.; Wenzel, W.; Böhm, K. J. (2009). Deposition of palladium nanoparticles on self-assembled, zinc-induced tubulin macrotubes and sheets. Journal of Nanoscience and Nanotechnology, 9, 6858–65. doi:10.1166/jnn.2009.1476
Skupien, K.; Putyra, P.; Walter, J.; Kozlowski, R. H.; Khelashvili, G.; Hinsch, A.; Würfel, U. (2009). Catalytic materials manufactured by the polyol process for monolithic dye-sensitized solar cells. Progress in Photovoltaics: Research and Applications, 17, 67–73. doi:10.1002/pip.854
Schulenburg, H.; Müller, E.; Khelashvili, G.; Roser, T.; Bönnemann, H.; Wokaun, A.; Scherer, G. G. (2009). Heat-treated PtCo₃ nanoparticles as oxygen reduction catalysts. Journal of Physical Chemistry C, 113, 4069–77. doi:10.1021/jp808134j
Döring, M.; Arnold, U. (2009). Polymerization of epoxy resins initiated by metal complexes. Polymer International, 58, 976–88. doi:10.1002/pi.2618
Behrens, S.; Heyman, A.; Maul, R.; Essig, S.; Steigerwald, S.; Quintilla, A.; Wenzel, W.; Bürck, J.; Dgany, O.; Shoseyov, O. (2009). Constrained synthesis and organization of catalytically active metal nanoparticles by self-assembled protein templates. Advanced materials, 21, 3515–19. doi:10.1002/adma.200900487
Kruse, A.; Ederer, H.; Ernst, D.; Seine, B. (2009). Measurement of residence time in hot compressed water. 2. Salts in a continuously stirred tank reactor. Chemical Engineering and Technology, 32, 971–76. doi:10.1002/ceat.200900031
Sysoev, V. V.; Schneider, T.; Goschnick, J.; Kiselev, I.; Habicht, W.; Hahn, H.; Strelcov, E.; Kolmakov, A. (2009). Percolating SnO₂ nanowire network as a stable gas sensor: direct comparison of long-term performance versus SnO₂ nanoparticle films. Sensors and Actuators B, 139, 699–703. doi:10.1016/j.snb.2009.03.065
Kruse, A. (2009). Hydrothermal biomass gasification. Journal of Supercritical Fluids, 47, 391–99. doi:10.1016/j.supflu.2008.10.009
Otto, T. N.; Mas, C.; Ederer, H.; Powietzka, B.; Dinjus, E. (2009). Modellrechnungen für die heterogen katalysierte Epoxidierung von 1,3-Butadien zu 3,4-Epoxy-1-buten im Labor-Rohrreaktor. Chemie Ingenieur Technik, 81, 449–57. doi:10.1002/cite.200800190
Otto, T.; Pfeifer, P.; Pitter, S.; Powietzka, B. (2009). Organische Synthese im Mikroreaktor. Heterogen katalysierte Epoxidierung von 1,3-Butadien. Chemie Ingenieur Technik, 81, 349–56. doi:10.1002/cite.200800151
Schramm, F.; Chandrasekar, R.; Zevaco, T. A.; Rudolph, M.; Görls, H.; Poppitz, W.; Ruben, M. (2009). (Polypyridyl)ruthenium(II) complexes based on a back-to-back bis(pyrazolylpyridine) bridging ligand. European Journal of Inorganic Chemistry, (2009), 53–61. doi:10.1002/ejic.200800628
Wiegand, G.; Johnsen, S.; Zehnder, B. (2009). Maßgeschneidertes NIR-inline-Monitoring-Modul. Einsparung bei der Naturstoffextraktion und Teilereinigung mit CO₂. CITplus, (2009) -8, (7), 41–43.
Einhardt, D.; Paris, K. (2009). Von der Boran-Chemie zur Nanotechnologie. VDI achrichten, 35 (2), 16–20.
2008
Book Chapters
Behrens, S. (2008). Biologically templated nanostructure assemblies. Lukehart, C. [Hrsg.] Nanomaterials : Inorganic and Bioinorganic Perspectives Chichester : Wiley, 2008 S. ?? - ?? (Encyclopedia of Inorganic Chemistry ; 2).
Pitter, S.; Dinjus, E.; Ionescu, C.; Maniut, C.; Makarczyk, P.; Patcas, F. (2008). Evaluation of supercritical carbon dioxide as a tuneable reaction medium for homogeneous catalysis. Leitner, W. [Hrsg.] Regulated Systems for Multiphase Catalysis Berlin [u.a.] : Springer, 2008 (Topics in Organometallic Chemistry ; 23), 109–47.
Arnold, U. (2008). Metal species supported on organic polymers as catalysts for the epoxidation of alkenes. Oyama, S.T. [Hrsg.] Mechanisms in Homogeneous and Heterogeneous Epoxidation Catalysis Amsterdam [u.a.] : Elsevier, 2008, 387–411.
Dahmen, N.; Dinjus, E.; Henrich, E. (2008). Synthesekraftstoffe aus Biomasse. Das Karlsruher Verfahren bioliq. Synthetic fuels from the biomass. The Karlsruhe process bioliq. Bührke, T. [Hrsg.] Erneuerbare Energie : alternative Energiekonzepte für die Zukunft Weinheim : Wiley-VCH, 2007 S.59-63 ISBN 978-3-527-40727-9 Wengenmayr, R. [Hrsg.] Renewable Energy : Sustainable Energy Concepts for the Future Weinheim : Wiley-VCH, 2008 S.61-65 ISBN 978-3-527-40804-7.
Journal Articles
Biemann, L.; Häber, T.; Maydt, D.; Schaper, K.; Kleinermanns, K. (2008). Structural assignment of adenine aggregates in CD Cl₃. The Journal of Chemical Physics, 128 (19), Art.-Nr.: 195103. doi:10.1063/1.2912064
Busker, M.; Häber, T.; Nispel, M.; Kleinermanns, K. (2008). Isomer‐Selective Vibrational Spectroscopy of Benzene–Acetylene Aggregates: Comparison with the Structure of the Benzene–Acetylene Cocrystal. Angewandte Chemie International Edition, 47 (52), 10094–10097. doi:10.1002/anie.200802118
Busker, M.; Nispel, M.; Häber, T.; Kleinermanns, K.; Etinski, M.; Fleig, T. (2008). Electronic and Vibrational Spectroscopy of 1‐Methylthymine and its Water Clusters: The Dark State Survives Hydration. ChemPhysChem, 9 (11), 1570–1577. doi:10.1002/cphc.200800111
Häber, T.; Seefeld, K.; Engler, G.; Grimme, S.; Kleinermanns, K. (2008). IR/UV spectra and quantum chemical calculations of Trp–Ser: Stacking interactions between backbone and indole side-chain. Physical Chemistry Chemical Physics, 10 (19), 2844. doi:10.1039/b718710f
Hoffmann, T.; Pospiech, D.; Häussler, L.; Pötschke, P.; Reuter, U.; Werner, P.; Sandler, J. K. W.; Döring, M.; Altstädt, V. (2008). Properties of segmented block copolymers in PEEK/PSU blends. High Performance Polymers, 20, 601–614. doi:10.1177/0954008307082176
Turba, S.; Walter, O.; Schindler, S.; Nielsen, L. P.; Hazell, A.; McKenzie, C. J.; Lloret, F.; Cano, J.; Julve, M. (2008). Syntheses, structures, and properties of Copper(II) complexes of bis(2-pyridylmethyl) derivatives of o-, m-, and p-phenylenediamine and aniline. Inorganic Chemistry, 47, 9612–23. doi:10.1021/ic800244g
Schartel, B.; Braun, U.; Balabanovich, A. I.; Artner, J.; Ciesielski, M.; Döring, M.; Perez, R. M.; Sandler, J. K. W.; Altstädt, V. (2008). Pyrolysis and fire behaviour of epoxy systems containing a novel 9,10-dihydro-9-oxa-10-phosphaphenanthrene-10-oxide-(DOPO)-based diamino hardener. European Polymer Journal, 44, 704–715. doi:10.1016/j.eurpolymj.2008.01.017
Domide, D.; Kaifer, E.; Mautz, J.; Walter, O.; Behrens, S.; Himmel, H. J. (2008). Synthesis and characterisation of some new zinc carbamate complexes formed by CO₂ fixation and their use as precursors for ZnO particles under mild conditions. European Journal of Inorganic Chemistry, (2008), 3177–85. doi:10.1002/ejic.200701308
Ciesielski, M.; Schäfer, A.; Döring, M. (2008). Novel efficient DOPO-based flame-retardants for PWB relevant epoxy resins with high glass transition temperatures. Polymers for Advanced Technologies, 189, 507–15. doi:10.1002/pat.1090
Kruse, A.; Ederer, H.; Ernst, D.; Seine, B. (2008). Verweilzeitmessung in heißem Hochdruckwasser 2. Salze im kontinuierlichen Rührkessel. Chemie Ingenieur Technik, 80, 1809–14. doi:10.1002/cite.200800097
Artner, J.; Ciesielski, M.; Walter, O.; Döring, M.; Perez, R. M.; Sandler, J. K. W.; Altstädt, V.; Schartel, B. (2008). A novel DOPO-based diamine as hardener and flame retardant for epoxy resin systems. Macromolecular Materials and Engineering, 293, 503–14. doi:10.1002/mame.200700287
Seibold, S.; Schäfer, A.; Lohstroh, W.; Walter, O.; Döring, M. (2008). Phosphorus-containing terephthaldialdehyde adducts. Structure determination and their application as flame retardants in epoxy resins. Journal of Applied Polymer Science, 108, 264–71. doi:10.1002/app.27550
Schäfer, A.; Seibold, S.; Walter, O.; Döring, M. (2008). Novel high Tsub(g) flame retardancy approach for epoxy resins. Polymer, Degradation and Stability, 93, 557–60. doi:10.1016/j.polymdegradstab.2007.11.016
Padelkova, Z.; Weidlich, T.; Kolarova, L.; Eisner, A.; Cisarova, I.; Zevaco, T. A.; Ruzicka, A. (2008). Products of hydrolysis of C,N-chelated triorganotin(IV) chlorides and use of products as catalysts in transesterification reactions. Journal of Organometallic Chemistry, 692, 5633–45. doi:10.1016/j.jorganchem.2007.09.018
Broggi, J.; Joubert, N.; Aucagne, V.; Zevaco, T.; Berteina-Raboin, S.; Nolan, S. P.; Agrofoglio, L. A. (2008). Study of different copper (I) catalysts for the ’click chemistry’ approach to carbanucleosides. Nucleosides, Nucleotides and Nucleic Acids, 26, 779–83. doi:10.1080/15257770701501492
Karayildirim, T.; Sinag, A.; Kruse, A. (2008). Char and coke formation as unwanted side reaction of the hydrothermal biomass gasification. Chemical Engineering and Technology, 31, 1561–68. doi:10.1002/ceat.200800278
Gürler, C.; Feyen, M.; Behrens, S.; Matoussevitch, N.; Schmidt, A. M. (2008). One-step synthesis of functional Co nanoparticles for surface-initiated. Polymer, 49, 2211–16. doi:10.1016/j.polymer.2008.03.012
Behrens, S. (2008). Synthesis of inorganic nanomaterials mediated by protein assemblies. Journal of Materials Chemistry, 18, 3788–98. doi:10.1039/b806551a
Hinsch, A.; Behrens, S.; Berginc, M.; Bönnemann, H.; Brandt, H.; Drewitz, A.; Einsele, F.; Faßler, D.; Gerhard, D.; Gores, H.; Haag, R.; Herzig, T.; Himmler, S.; Khelashvili, G.; Koch, D.; Nazmutdinova, G.; Opara-Krasovec, U.; Putyra, P.; Rau, U.; Sastrawan, R.; Schauer, T.; Schreiner, C.; Sensfuss, S.; Siegers, C.; Skupien, K.; Wachter, P.; Walter, J.; Wasserscheid, P.; Würfel, U.; Zistler, M. (2008). Material development for dye solar modules: results from an integrated approach. Progress in Photovoltaics: Research and Applications, 16, 489–501. doi:10.1002/pip.832
Kruse, A.; Vogel, H. (2008). Heterogeneous catalysis in supercritical media, Part 3: Other media. Chemical Engineering and Technology, 31, 1391–95. doi:10.1002/ceat.200800086
Kruse, A. (2008). Supercritical water gasification. Biofuels, bioproducts and biorefining, Bioproducts and Biorefining, 2 (5), 415–37. doi:10.1002/bbb.93
Yanik, J.; Ebale, S.; Kruse, A.; Saglam, M.; Yüksel, M. (2008). Biomass gasification in supercritical water: II. Effect of catalyst. International journal of hydrogen energy, 33 (17), 4520–26. doi:10.1016/j.ijhydene.2008.06.024
Barriau, E.; Schmidt-Freytag, U.; Roth, M.; Gehring, J.; Simon, N.; Wolff-Fabris, F.; Altstaedt, V.; Döring, M.; Arnold, U. (2008). Silver Olefin Complexes: Highly Efficient Initiators for the Electron Beam Curing of Epoxy Resins. Macromolecules, 41 (11), 3779–3781. doi:10.1021/ma800309r
Aschenbrenner, O.; Dahmen, N.; Schaber, K. H.; Dinjus, E. (2008). Adsorption of dimethyl(1,5-cyclooctadiene)platinum on porous supports in supercritical carbon dioxide. Industrial and Engineering Chemistry Research, 47, 3150–55. doi:10.1021/ie071221h
Kruse, A.; Vogel, H. (2008). Heterogeneous catalysis in supercritical media: 2 Near-critical and supercritical water. Chemical Engineering and Technology, 31, 1241–45. doi:10.1002/ceat.200800085
Kruse, A.; Vogel, H. (2008). Heterogene Katalyse in überkritischen Medien. Teil 3: Sonstige. Chemie Ingenieur Technik, 80, 911–17. doi:10.1002/cite.200800039
Kruse, A.; Vogel, H. (2008). Heterogene Katalyse in überkritischen Medien. 2.Nah- und überkritsches Wasser. Chemie Ingenieur Technik, 80, 567–72. doi:10.1002/cite.200700172
Artner, J.; Bautz, H.; Fan, F.; Habicht, W.; Walter, O.; Döring, M.; Arnold, U. (2008). Metal-doped epoxy resins: Easily accessible, durable, and highly versatile catalysts. Journal of Catalysis, 255, 180–89. doi:10.1016/j.jcat.2008.02.003
Kruse, A.; Vogel, H. (2008). Heterogeneous catalysis in supercritical media: 1.carbon dioxide. Chemical Engineering and Technology, 31, 23–32. doi:10.1002/ceat.200700366
Morgenstern, A.; Abbas, K.; Bruchertseifer, F.; Montavon, G.; Repinc, U.; Walter, O.; Apostolidis, C. (2008). Study of 2,9-dicarboxy-1,10-phenanthroline as potential chelate for the synthesis of ²³⁰U-labeled radioconjugates. Cancer Biotherapy and Radiopharmaceuticals, 12th Conf.on Cancer Therapy with Antibodies and Immunoconjugates, Parsippany, N.J., October 16-18, 2008, (Abstract), 23, 513. doi:10.1089/cbr.2008.12Conf-3
2007
Book Chapters
Kruse, A.; Dinjus, E. (2007). Chemical reaction modeling in supercritical fluids in special consideration of reactions in supercritical water. Keil, F.J. [Hrsg.] Modeling of Process Intensification Weinheim : Wiley-VCH, 2007, 165–91.
Journal Articles
Häber, T.; Seefeld, K.; Kleinermanns, K. (2007). Mid- and Near-Infrared Spectra of Conformers of H-Pro-Trp-OH. The Journal of Physical Chemistry A, 111 (16), 3038–3046. doi:10.1021/jp070571e
Seefeld, K.; Brause, R.; Häber, T.; Kleinermanns, K. (2007). Imino Tautomers of Gas-Phase Guanine from Mid-Infrared Laser Spectroscopy. The journal of physical chemistry / A, 111 (28), 6217–6221. doi:10.1021/jp0715169
Lindqvist-Reis, P.; Apostolidis, C.; Rebizant, J.; Morgenstern, A.; Klenze, R.; Walter, O.; Fanghänel, T.; Haire, R. G. (2007). The structures and optical spectra of hydrated transplutonium ions in the solid state and in solution. Angewandte Chemie - International Edition, 46, 919–22. doi:10.1002/anie.200603947
Zevaco, T. A.; Männle, D.; Walter, O.; Dinjus, E. (2007). An easy way to achieve three-dimensional metal-organic coordination polymers: synthesis and crystal structure of dizinc diisophthalate bis-dimethylsulfoxide monohydrate: [Zn₂(ip)₄(DMSO)₂(H₂O).3 DMSO]sub(n). Applied Organometallic Chemistry, 21, 970–77. doi:10.1002/aoc.1325
Seredynska, D.; Ullrich, G.; Wiegand, G.; Dahmen, N.; Dinjus, E. (2007). High-Pressure Vapor-Liquid Equilibria for CO₂ + Hexanal at (323.15, 353.15, and 383.15) K. Journal of Chemical and Engineering Data, 52, 2284–87. doi:10.1021/je700303v
Müller, J.; Würtele, C.; Walter, O.; Schindler, S. (2007). Transformation of nitrile to cyanide and aldehyde using a cobalt(II) complex and dioxygen. Angewandte Chemie - International Edition, 46, 7775–77. doi:10.1002/anie.200701408
Kulesza, P. J.; Miecznikowski, K.; Baranowska, B.; Skunik, M.; Kolary-Zurowska, A.; Lewera, A.; Karnicka, K.; Chojak, M.; Rutkowska, I.; Fiechter, S.; Bogdanoff, P.; Dorbandt, I.; Zehl, G.; Hiesgen, R.; Dirk, E.; Nagabhushana, K. S.; Boennemann, H. (2007). Electroreduction of oxygen at tungsten oxide modified carbon-supported RuSeₓ nanoparticles. Journal of Applied Electrochemistry, 37, 1439–46. doi:10.1007/s10800-007-9349-6
Colmenares, L.; Guerrini, E.; Jusys, Z.; Nagabhushana, K. S.; Dinjus, E.; Behrens, S.; Habicht, W.; Bönnemann, H.; Behm, R. J. (2007). Activity, selectivity, and methanol tolerance of novel carbon-supported Pt and Pt₃Me (Me = Ni, Co) cathode catalysts. Journal of Applied Electrochemistry, 37, 1413–27. doi:10.1007/s10800-007-9353-x
Yanik, J.; Kornmayer, C.; Saglam, M.; Mithat, Y. (2007). Fast pyrolysis of agricultural wastes: Characterization of pyrolysis products. Fuel processing technology, 88 (10), 942–47. doi:10.1016/j.fuproc.2007.05.002
Bogolowski, N.; Nagel, T.; Lanova, B.; Ernst, S.; Baltruschat, H.; Nagabhushana, K. S.; Bönnemann, H. (2007). Activity of selenium modified ruthenium-electrodes and determination of the real surface area. Journal of Applied Electrochemistry, 37, 1485–94. doi:10.1007/s10800-007-9378-1
Perez, R. M.; Sandler, J. K. W.; Altstädt, V.; Hoffmann, T.; Pospiech, D.; Artner, J.; Ciesielski, M.; Döring, M.; Balabanovich, A. I.; Knoll, U.; Braun, U.; Schartel, B. (2007). Novel phosphorus-containing hardeners with tailored chemical structures for epoxy resins: Synthesis and cured resin properties. Journal of Applied Polymer Science, 105, 2744–59. doi:10.1002/app.26537
Nagabhushana, K.; Dinjus, E.; Bönnemann, H.; Zaikovskii, V.; Hartnig, C.; Zehl, G.; Dorbandt, I.; Fiechter, S.; Bogdanoff, P. (2007). Reductive annealing for generating Se doped 20 wt% Ru/C cathode catalysts for the oxygen reduction reaction. Journal of Applied Electrochemistry, 37, 1515–22. doi:10.1007/s10800-007-9423-0
Artner, J.; Ciesielski, M.; Ahlmann, M.; Walter, O.; Döring, M.; Perez, R. M.; Altstädt, V.; Sandler, J. K.; Schartel, B. (2007). A novel and effective synthetic approach to 9,10-dihydro-9-oxa-10-phosphaphenanthrene-10-oxide (DOPO) derivatives. Phosphorus, Sulfur, and Silicon and the Related Elements, 182, 2131–48. doi:10.1080/10426500701407417
Habicht, W.; Behrens, S.; Böhm, K. J.; Dinjus, E. (2007). FESEM/EDX and AFM assisted characterization of tubulin derivatives used for template-directed metallization. Microscopy and Microanalysis, Suppl.S02, 13, 670–71. doi:10.1017/S1431927607074624
Yanik, J.; Ebale, S.; Kruse, A.; Saglam, M.; Yüksel, M. (2007). Biomass gasification in supercritical water: Part 1. Effect of the nature of biomass. Fuel, 86, 2410–15. doi:10.1016/j.fuel.2007.01.025
Aschenbrenner, O.; Kemper, S.; Dahmen, N.; Schaber, K. H.; Dinjus, E. (2007). Solubility of β-diketonates, cyclopentadienyls, and cyclooctadiene complexes with various metals in supercritical carbon dioxide. Journal of Suercritical Fluids, 41, 179–86. doi:10.1016/j.supflu.2006.10.011
Schäfer, A.; Seibold, S.; Lohstroh, W.; Walter, O.; Döring, M. (2007). Synthesis and properties of flame-retardant epoxy resins based on DOPO and one of its analog DPPO. Journal of Applied Polymer Science, 105, 685–96. doi:10.1002/app.26073
Zeisberger, M.; Dutz, S.; Müller, R.; Hergt, R.; Matoussevitch, N.; Bönnemann, H. (2007). Metallic cobalt nanoparticles for heating applications. Journal of Magnetism and Magnetic Materials, 311, 224–27. doi:10.1016/j.jmmm.2006.11.178
Schartel, B.; Balabanovich, A. I.; Braun, U.; Knoll, U.; Artner, J.; Ciesielski, M.; Döring, M.; Perez, R.; Sandler, J. K. W.; Altstädt, V.; Hoffmann, T.; Pospiech, D. (2007). Pyrolysis of epoxy resins and fire behavior of epoxy resin composites flame-retarded with 9,10-dihydro-9-oxa-10-phosphaphenanthrene-10-oxide additives. Journal of Applied Polymer Science, 104, 2260–69. doi:10.1002/app.25660
Perez, R. M.; Sandler, J. K. W.; Altstädt, V.; Hoffmann, T.; Pospiech, D.; Ciesielski, M.; Döring, M.; Braun, U.; Balabanovich, A. I.; Schartel, B. (2007). Novel phosphorus-modified polysulfone as a combined flame retardant and toughness modifier for epoxy resins. Polymer, 48, 778–90. doi:10.1016/j.polymer.2006.12.011
Vidakovic, T.; Christov, M.; Sundmacher, K.; Nagabhushana, K. S.; Fei, W.; Kinge, S.; Bönnemann, H. (2007). PtRu colloidal catalysts: Characterisation and determination of kinetics for methanol oxidation. Electrochimica Acta, 52, 2277–84. doi:10.1016/j.electacta.2006.03.110
Patcas, F.; Krysmann, W. (2007). Efficient catalysts with controlled porous structure obtained by anodic oxidation under spark-discharge. Applied Catalysis A, 316, 240–49. doi:10.1016/j.apcata.2006.09.028
Patcas, F.; Maniut, C.; Ionescu, C.; Pitter, S.; Dinjus, E. (2007). Supercritical carbon dioxide as an alternative reaction medium for hydroformylation with integrated catalyst recycling. Applied Catalysis B, 70, 630–36. doi:10.1016/j.apcatb.2006.01.013
Kvamme, B.; Kuznetsova, T.; Hebach, A.; Oberhof, A.; Lunde, E. (2007). Measurements and modelling of interfacial tension for water + carbon dioxide systems at elevated pressures. Computational Materials Science, 38, 506–13. doi:10.1016/j.commatsci.2006.01.020
Elschenbroich, C.; Kanellakopoulos, B.; Köhler, F. H.; Metz, B.; Lescouezec, R.; Mitzel, N. W.; Strauss, W. (2007). Magnetic face-to-face interaction and electrocommunication in chromium sandwich compounds. Chemistry - A European Journal, 13, 1191–1200. doi:10.1002/chem.200600717
Abeln, J.; Kluth, M.; Pagel, M. (2007). Results and rough cost estimation for SCWO of painting effluents using a transpiring wall and a pipe reactor. Journal of Advanced Oxidation Technologies, 10, 169–76.
Kruse, A.; Faquir, M. (2007). Hydrothermal biomass gasification. Effects of salts, backmixing and their interaction. Chemical Engineering and Technology, 30, 749–54. doi:10.1002/ceat.200600409
Kruse, A.; Vogel, H. (2007). Heterogene Katalyse in überkritischen Medien. 1.Kohlendioxid. Chemie Ingenieur Technik, 79, 707–20. doi:10.1002/cite.200700059
Deglmann, P.; Ember, E.; Hofmann, P.; Pitter, S.; Walter, O. (2007). Experimental and theoretical investigations on the catalytic hydrosilylation of carbon dioxide with ruthenium nitrile complexes. Chemistry - A European Journal, 13, 2864–79. doi:10.1002/chem.200600396
Zevaco, T. A.; Janssen, A.; Dinjus, E. (2007). Zinc(II)-pyridine-2-carboxylate / 1-methyl-imidazole: a binary catalytic system for the synthesis of cyclic carbonates from carbon dioxide and epoxides. ARKIVOC, (2007) iii, 151–63.
Zevaco, T. A.; Sypien, J. K.; Janssen, A.; Walter, O.; Dinus, E. (2007). Synthesis, structural characterisation of new oligomeric alkyl aluminium (2,2’-methylene-p-chloro-bisphenoxides) and application as catalysts in polymerisation reactions involving cyclohexene oxide. Journal of Organometallic Chemistry, 692, 1963–73. doi:10.1016/j.jorganchem.2007.01.019
Kruse, A.; Dinjus, E. (2007). Hot compressed water as reaction medium and reactant. 2. Degradation reactions. Journal of Supercritical Fluids, 41, 361–79. doi:10.1016/j.supflu.2006.12.006
Kruse, A.; Faquir, M. (2007). Hydrothermale Vergasung: Ansätze einer reaktionstechnischen Optimierung. Chemie Ingenieur Technik, 79, 544–47. doi:10.1002/cite.200600158
Khelashvili, G.; Behrens, S.; Hinsch, A.; Habicht, W.; Schild, D.; Eichhöfer, A.; Sastrawan, R.; Skupien, K.; Dinjus, E.; Bönnemann, H. (2007). Preparation and characterisation of low platinum loaded Pt:SnO₂ electrocatalytic films for screen printed dye solar cell counter electrode. Thin Solid Films, 515, 4074–79. doi:10.1016/j.tsf.2006.11.005
Matoussevitch, N.; Gorschinski, A.; Habicht, W.; Bolle, J.; Dinjus, E.; Bönnemann, H.; Behrens, S. (2007). Surface modification of metallic Co nanoparticles. Journal of Magnetism and Magnetic Materials, 311, 92–96. doi:10.1016/j.jmmm.2006.10.1203
Foxon, S.; Xu, J. Y.; Turba, S.; Leibold, M.; Hampel, F.; Heinemann, F. W.; Walter, O.; Würtele, C.; Holthausen, M.; Schindler, S. (2007). Syntheses, Characterization and reactivity of iron(II), nickel(II), copper(II) and zinc(II) complexes of the ligand N,N,N’,N’-tetrakis(2-pyridylmethyl)-benzene-1,3-diamine (1,3-tpbd) and its phenol derivative 2,6-bis[bis(2-pyridylmethyl)aminol-p-cresol (2,6-tpcd). European Journal of Inorganic Chemistry, (2007), 429–43. doi:10.1002/ejic.200600944
Arnold, U.; Fan, F.; Habicht, W.; Döring, M. (2007). Molybdenum-doped epoxy resins as catalysis for the epoxidation of alkenes. Journal of Catalysis, 245, 55–64. doi:10.1016/j.jcat.2006.09.017
Kruse, A.; Dinjus, E. (2007). Hot compressed water as reaction medium and reactant properties and synthesis reactions. The journal of supercritical fluids, 39 (3), 362–80. doi:10.1016/j.supflu.2006.03.016
Kruse, A.; Maniam, P.; Spieler, F. (2007). Influence of proteins on the hydrothermal gasification and liquefaction of biomass. 2.Model compounds. Industrial and Engineering Chemistry Research, 46, 87–96. doi:10.1021/ie061047h
Dahmen, N.; Griesheimer, P.; Hebach, A. (2007). Reinigung und Oberflächenbehandlung mit komprimiertem Kohlendioxid. Galvanotechnik, 98, 1111–1120.
Lindqvist-Reis, P.; Apostolidis, C.; Rebizant, J.; Morgenstern, A.; Klenze, R.; Walter, O.; Fanghänel, T.; Haire, R. G. (2007). The structures and optical spectra of hydrated transplutonium ions in the solid state and in solution. Angewandte Chemie, 119, 937–40. doi:10.1002/ange.200603947
Habicht, W.; Behrens, S.; Böhm, K. J.; Dinjus, E. (2007). Imaging of self-assembled tubulin polymorphs used as metallization templates. Journal of Physics: Conference Series, 61, 374–78. doi:10.1088/1742-6596/61/1/075
Dahmen, N.; Dinjus, E.; Henrich, E. (2007). Synthesis gas from biomass. Problems and solutions en route to technical realization. Erdöl - Erdgas - Kohle, 123(2007), S.OG31 Oil Gas European Magazine, 33(2007), (3), 31–34.
2006
Book Chapters
Dahmen, N.; Griesheimer, P.; Hebach, A. (2006). Reinigung und Oberflächenbehandlung mit komprimiertem Kohlendioxid. Suchentrunk, R. [Hrsg.] Jahrbuch Oberflächentechnik Bad Saulgau : Eugen G.Leuze Verl. Bd.61 (2005), 138–47.
Journal Articles
Häber, T.; Blair, A. C.; Nesbitt, D. J.; Schuder, M. D. (2006). CH stretch/internal rotor dynamics in ethyl radical: High-resolution spectroscopy in the CH₃-stretch manifold. The Journal of Chemical Physics, 124 (5), Art.-Nr.: 054316. doi:10.1063/1.2140740
Scharge, T.; Emmeluth, C.; Häber, T.; Suhm, M. A. (2006). Competing hydrogen bond topologies in 2-fluoroethanol dimer. Journal of Molecular Structure, 786 (2-3), 86–95. doi:10.1016/j.molstruc.2005.09.022
Scharge, T.; Häber, T.; Suhm, M. A. (2006). Quantitative chirality synchronization in trifluoroethanol dimers. Physical chemistry, chemical physics, 8 (40), 4664–4667. doi:10.1039/B609868A
Whitney, E. S.; Haeber, T.; Schuder, M. D.; Blair, A. C.; Nesbitt, D. J. (2006). High-resolution infrared studies in slit supersonic discharges: CH₂ stretch excitation of jet-cooled CH₂Cl radical. The Journal of Chemical Physics, 125 (5), Art.-Nr.: 054303. doi:10.1063/1.2208612
Raffelt, K.; Henrich, E.; Koegel, A.; Stahl, R.; Steinhardt, J.; Weirich, F. (2006). The BTL2 Process of Biomass Utilization Entrained-Flow Gasification of Pyrolyzed Biomass Slurries. Applied biochemistry and biotechnology, 129 (1-3), 153–164. doi:10.1385/ABAB:129:1:153
Braun, U.; Balabanovich, A. I.; Schartel, B.; Knoll, U.; Artner, J.; Ciesielski, M.; Döring, M.; Perez, R.; Sandler, J. K. W.; Altstädt, V.; Hoffmann, T.; Pospiech, D. (2006). Influence of the oxidation state of phosphorus on the decomposition and fire behaviour of flame-retarded epoxy resin composites. Polymer, (2006), 47 (26), 8495–8508. doi:10.1016/j.polymer.2006.10.022
Korosoglou, G.; Behrens, S.; Bekeredjian, R.; Hardt, S.; Hagenmueller, M.; Dinjus, E.; Böhm, K. J.; Unger, E.; Katus, H. A.; Kuecherer, H. (2006). The potential of a new stable ultrasound contrast agent for site-specific targeting. An in vitro experiment. Ultrasound in Medicine and Biology, 32, 1473–78. doi:10.1016/j.ultrasmedbio.2006.06.025
Watanabe, M.; Bayer, F.; Kruse, A. (2006). Oil formation from glucose with formic acid and cobalt catalyst in hot-compressed water. Carbohydrate Research, 341, 2891–2900. doi:10.1016/j.carres.2006.10.011
Amberger, H. D.; Zhang, L.; Reddmann, H.; Apostolidis, C.; Walter, O. (2006). Zur Elektronenstruktur metallorganischer Komplexe der f-Elemente. 64[1]. Äußert sich die zwitterionische Natur des Triphenylphosphosphanoxid-Liganden auch in seinen spektrochemischen Eigenschaften?. Zeitschrift für Anorganische und Allgemeine Chemie, 632, 2467–70. doi:10.1002/zaac.200600220
Kruse, A.; Dahmen, N.; Dinjus, E.; Ederer, H. (2006). Oxidation of hexanal to hexanoic acid in supercritical carbon dioxide. 1. Experiments in a tubular reactor and modeling. Journal of Supercritical Fluids, 39, 211–19. doi:10.1016/j.supflu.2006.04.001
Behrens, S.; Bönnemann, H.; Matoussevitch, N.; Gorschinski, A.; Dinjus, E.; Habicht, W.; Bolle, J.; Zinoveva, S.; Palina, N.; Hormes, J.; Modrow, H.; Bahr, S.; Kempter, V. (2006). Surface engineering of Co and FeCo nanoparticles for biomedical application. Journal of Physics: Condensed Matter, 18, S2543-S2561. doi:10.1088/0953-8984/18/38/S02
Patcas, F.; Patcas, F. C. (2006). Reaction pathways and kinetics of the gas-phase oxidation of cyclohexane on NiO/γ-Al₂O₃ catalyst. Catalysis Today, 117, 253–58. doi:10.1016/j.cattod.2006.05.052
Jank, S.; Reddmann, H.; Apostolidis, C.; Walter, O.; Amberger, H. D. (2006). Zur Elektronenstruktur metallorganischer Komplexe der f-Elemente. 63 Parametrische Analyse des Kristallfeld-Aufspaltungsmusters von pseudo trigonal-planarem Er(η⁵-C₅H₄tBu)₃. Zeitschrift für Anorganische und Allgemeine Chemie, 632, 1979–82. doi:10.1002/zaac.200600123
Bujnowski, K.; Synoradzki, L.; Zevaco, T.; Dinjus, E.; Augustynowicz-Kopec, E.; Zwolska, Z. (2006). Study of the reaction of 3-formylrifamycin SV with gaseous ammonia and acetone. European Journal of Organic Chemistry, 18, 4153–63. doi:10.1002/ejoc.200600184
Habicht, W.; Boukis, N.; Franz, G.; Walter, O.; Dinjus, E. (2006). Exploring hydrothermally grown potassium titanate fibers by STEM-in-SEM/EDX and XRD. Microscopy and Microanalysis, 12, 322–26. doi:10.1017/S1431927606060429
Kröger, M.; Folli, C.; Walter, O.; Döring, M. (2006). A new amidoimidomalonate zinc complex with a sedecameric solid state structure catalyzing the copolymerization of CO₂ and cyclohexene oxide. Journal of Organometallic Chemistry, 691, 3397–3402. doi:10.1016/j.jorganchem.2006.04.018
Reddmann, H.; Apostolidis, C.; Walter, O.; Amberger, H. D. (2006). Zur Elektronenstruktur hochsymmetrischer Verbindungen der f-Elemente. 40. Parametrische Analyse des Kristallfeld-Aufspaltungsmusters von Tris(hydrotris(1-pyrazolyl)borato)neodym(III). Zeitschrift für Anorganische und Allgemeine Chemie, 632, 1405–08. doi:10.1002/zaac.200600056
Perez, R. M.; Sandler, J. K. W.; Altstädt, V.; Hoffmann, T.; Pospiech, D.; Ciesielski, M.; Döring, M.; Braun, U.; Knoll, U.; Schartel, B. (2006). Effective halogen-free flame retardants for carbon fibre-reinforced epoxy composites. Journal of Materials Science, 41, 4981–84. doi:10.1007/s10853-006-0134-4
Zevaco, T. A.; Sypien, J.; Janssen, A.; Walter, O.; Dinjus, E. (2006). Aluminum bisphenoxides: Promising challengers for a catalyzed copolymerization of cyclohexene oxide with CO2. Catalysis Today, 115, 151–61. doi:10.1016/j.cattod.2006.02.072
Kröger, M.; Döring, M. (2006). 3-Amino-2-cyano-imidoacrylate ligands and their zinc complexes for the copolymerisation of CO₂ and epoxides: Living character and temperature optimisation. Catalysis Today, 115, 146–50. doi:10.1016/j.cattod.2006.02.044
Khelashvili, G.; Behrens, S.; Weidenthaler, C.; Vetter, C.; Hinsch, A.; Kern, R.; Skupien, K.; Dinjus, E.; Bönnemann, H. (2006). Catalytic platinum layers for dye solar cells. A comparative study. Thin Solid Films, 511-512, 342–48. doi:10.1016/j.tsf.2005.12.059
D’Jesús, P.; Boukis, N.; Kraushaar-Czarnetzki, B.; Dinjus, E. (2006). Influence of Process Variables on Gasification of Corn Silage in Supercritical Water. Industrial & engineering chemistry research, 45 (5), 1622–1630. doi:10.1021/ie050367i
D’Jesús, P.; Boukis, N.; Kraushaar-Czarnetzki, B.; Dinjus, E. (2006). Gasification of corn and clover grass in supercritical water. Fuel, 85 (7-8), 1032–1038. doi:10.1016/j.fuel.2005.10.022
Behrens, S.; Habicht, W.; Wu, J.; Unger, E. (2006). Tubulin assemblies as biomolecular templates for nanostructure synthesis: from nanoparticle arrays to nanowires. Surface and Interface Analysis, 38, 1014–18. doi:10.1002/sia.2334
Ahlmann, M.; Walter, O.; Frank, M.; Habicht, W. (2006). Phosphino-functionalised acetals of polyvinyl alcohol as the matrix for the immobilisation of Rh-based pre-catalysts for interfacial catalysis. Journal of Molecular Catalysis A: Chemical, 249, 80–92. doi:10.1016/j.molcata.2005.12.044
Xu, J. Y.; Astner, J.; Walter, O.; Heinemann, F. W.; Schindler, S.; Merkel, M.; Krebs, B. (2006). Iron(III) complexes with the ligand N’,N’-bis[(2-pyridyl)methyl]ethylenediamine (unspenp) and its amide derivative N-acetyl-N’,N’-bis[(2-pyridyl)methyl]ethylenediamine (acetyl-uns-penp). European Journal of Inorganic Chemistry, (2006), (8), 1601–10. doi:10.1002/ejic.200500902
Zaikovskii, V. I.; Nagabhushana, K. S.; Kriventsov, V. V.; Loponov, K. N.; Cherepanova, S. V.; Kvon, R. I.; Bönnemann, H.; Kochubey, D. I.; Savinova, E. R. (2006). Synthesis and structural characterization of Se-modified carbon-supported Ru nanoparticles for the oxygen reduction reaction. Journal of Physical Chemistry B, 110, 6881–90. doi:10.1021/jp056715b
Habicht, W.; Behrens, S.; Unger, E.; Dinjus, E. (2006). Cylindrical and ring-shaped tubulin assemblies as metallization templates explored by FESEM/EDX and SFM. Surface and Interface Analysis, 38, 194–97. doi:10.1002/sia.2256
Perez, R. M.; Sandler, J. K. W.; Alststädt, V.; Hoffmann, T.; Pospiech, D.; Ciesielski, M.; Döring, M. (2006). Effect of DOP-based compounds on fire retardancy, thermal stability, and mechanical properties of DGEBA cured with 4,4’-DDS. Journal of Materials Science, 41, 341–53. doi:10.1007/s10853-005-2720-2
Döring, M.; Hahn, G.; Imhof, W. (2006). Di-μ-bromo-2κ²Br:2’κ²Br-bis[bis(μ-acetylacetonato-1κO:2κO’)bromo-2κBr-bis(tetrahydrofuran-1κO)cadmium(II)nickel(II)]. Acta Crystallographica E, 62, m429-m431. doi:10.1107/S1600536806003643
Bürck, J.; Wiegand, G.; Roth, S.; Mathieu, H.; Krämer, K. (2006). Monitoring of technical oils in supercritical CO₂ under continuous flow conditions by NIR spectroscopy and multivariate calibration. Talanta, 68, 1497–1504. doi:10.1016/j.talanta.2005.08.009
Behrens, S.; Habicht, W.; Wagner, K.; Unger, E. (2006). Assembly of nanoparticle ring structures based on protein templates. Advanced Materials, 18, 284–89. doi:10.1002/adma.200501096
Behrens, S.; Bönnemann, H.; Matoussevitch, N.; Dinjus, E.; Modrow, H.; Palina, N.; Frerichs, M.; Kempter, V.; Maus-Friedrichs, W.; Heinemann, A.; Kammel, M.; Wiedenmann, A.; Pop, L.; Odenbach, S.; Uhlmann, E.; Bayat, N.; Hesselbach, J.; Guldbakke, J. M. (2006). Air-stable Co-, Fe-, and Fe/Co-nanoparticles and ferrofluids. Zeitschrift für physikalische Chemie, 220, 3–40. doi:10.1524/zpch.2006.220.1.1
Boukis, N.; Diem, V.; Galla, U.; Dinjus, E. (2006). Methanol reforming in supercritical water for hydrogen production. Combustion Science and Technology, 178, 467–85. doi:10.1080/00102200500292316
Arnold, U.; Walter, O.; Döring, M. (2006). Zinc coordination polymers with 1-(3-aminopropyl)-imidazole as bridging bidentate unit. Inorganica Chimica Acta, 359, 327–33. doi:10.1016/j.ica.2005.10.010
Arnold, U.; Habicht, W.; Döring, M. (2006). Metal-doped epoxy resins - new catalysts for the epoxidation of alkenes with high long-term activities. Advanced Synthesis and Catalysis, 348, 142–50. doi:10.1002/adsc.200505164
Dahmen, N.; Dinjus, E. (2006). Synthesekraftstoffe und Wasserstoff aus Biomasse. Nachrichten - Forschungszentrum Karlsruhe, 38, 53–55.
Henrich, E. (2006). Synthesekraftstoff aus Biomasse. Die SolarRegion - Zeitschrift für Erneuerbare Energien, 9 (3), 10.
Dahmen, N. (2006). Synthesekraftstoff aus Biomasse. AFZ-Der Wald, (2006), (10), 546–47.
2005
Journal Articles
Bakker, J. M.; Plützer, C.; Hünig, I.; Häber, T.; Compagnon, I.; von Helden, G.; Meijer, G.; Kleinermanns, K. (2005). Folding Structures of Isolated Peptides as Revealed by Gas‐Phase Mid‐Infrared Spectroscopy. ChemPhysChem, 6 (1), 120–128. doi:10.1002/cphc.200400345
Linder, R.; Nispel, M.; Häber, T.; Kleinermanns, K. (2005). Gas-phase FT-IR-spectra of natural amino acids. Chemical Physics Letters, 409 (4-6), 260–264. doi:10.1016/j.cplett.2005.04.109
Perkins, B. G.; Häber, T.; Nesbitt, D. J. (2005). Quantum State-Resolved Energy Transfer Dynamics at Gas−Liquid Interfaces: IR Laser Studies of CO₂ Scattering from Perfluorinated Liquids. The Journal of Physical Chemistry B, 109 (34), 16396–16405. doi:10.1021/jp0511404
Seefeld, K. A.; Plützer, C.; Löwenich, D.; Häber, T.; Linder, R.; Kleinermanns, K.; Tatchen, J.; Marian, C. M. (2005). Tautomers and electronic states of jet-cooled 2-aminopurine investigated by double resonance spectroscopy and theory. Physical chemistry, chemical physics, 7 (16), 3021–3026. doi:10.1039/b505954b
Ballivet-Tkatchenko, D.; Chermette, H.; Plasseraud, L.; Walter, O. (2005). Insertion reaction of carbon dioxide into Sn-OR bond. Synthesis, structure and DFT calculations of di- and tetranuclear isopropylcarbonato tin(IV) complexes. Dalton Transactions, 43(2006), 5167–75. doi:10.1039/b610812a
Schulz, P. S.; Walter, O.; Dinjus, E. (2005). Facile synthesis of a tricyclohexylphosphine-stabilized η³-allyl-carboxylato Ni(II) complex and its relevance in electrochemical butadiene carbon dioxide coupling. Applied Organometallic Chemistry, 19, 1176–79. doi:10.1002/aoc.993
D’Jesus, P.; Artiel, C.; Boukis, N.; Kraushaar-Czarnetzki, B.; Dinjus, E. (2005). Influence of educt preparation on gasification of corn silage in supercritical water. Industrial and engineering chemistry research, 44 (24), 9071–9077. doi:10.1021/ie0508637
Kröger, M.; Folli, C.; Walter, O.; Döring, M. (2005). Alternating copolymerization of cyclohexene oxide and CO₂ catalyzed by zinc complexes with new 3-Amino-2-cyanoimidoacrylate ligands. Advanced Synthesis and Catalysis, 347, 1325–28. doi:10.1002/adsc.200505113
Matsumura, Y.; Minowa, T.; Potic, B.; Kersten, S. R. A.; Prins, W.; Swaaij, W. P. M. van; Beld, B. van de; Elliott, D. C.; Neuenschwander, G. G.; Kruse, A.; Antal, M. J. J. (2005). Biomass gasification in near- and super-critical water: status and prospects. Biomass and Bioenergy, 29, 269–92. doi:10.1016/j.biombioe.2005.04.006
Bluhm, M. E.; Folly, C.; Pufky, D.; Kröger, M.; Walter, O.; Döring, M. (2005). 3-Aminoiminoacrylate, 3-aminoacrylate, and 3-amidoiminomalonate complexes as catalysts for the dimerization of olefins. Organometallics, 24, 4139–52. doi:10.1021/om049075s
Zevaco, T. A.; Janssen, A.; Sypien, J.; Dinjus, E. (2005). Aluminium triisopropoxide: An inexpensive and easy-to-handle catalyst of the copolymerisation of cyclohexene oxide with CO2. Green, chemistry, 7, 659–66. doi:10.1039/b504798f
Hebach, A.; Oberhof, A.; Dahmen, N.; Beeh, M. (2005). Commercial surfactants for use in CO₂ - a survey. Tenside Surfactants Detergents, 42, 78–81.
Beckert, R.; Fleischhauer, J.; Darsen, A.; Weston, J.; Schenk, S.; Batista, A.; Anders, E.; Görls, H.; Döring, M.; Pufky, D.; Walter, O. (2005). 1,2-diazetines as useful tools for ring transformation reactions with isothiocyanates - A new entry to 1,3,4-thiadiazines. Heterocycles, 65, 1311–1320.
Reddmann, H.; Apostolidis, C.; Walter, O.; Rebizant, J.; Amberger, H. D. (2005). Zur Elektronenstruktur hochsymmetrischer Verbindungen der f-Elemente. 38 [1] Kristall-, Molekül- und Elektronenstruktur von Tris(hydrotris(1-pyrazolyl)borato)-samarium(III). Zeitschrift für Anorganische und Allgemeine Chemie, 631, 1487–96. doi:10.1002/zaac.200500004
Ciesielski, M.; Pufky, D.; Döring, M. (2005). A convenient new synthesis of fused 1,2,4-triazoles: the oxidation of heterocyclic hydrazones using copper dichloride. Tetrahedron, 61, 5942–47. doi:10.1016/j.tet.2005.01.111
GNO Collaboration; Altmann, M.; Balata, M.; Belli, P.; Bellotti, E.; Bernabei, R.; Burkert, E.; Cattadori, C.; Cerulli, R.; Chiarini, M.; Cribier, M.; D’Angelo, S.; Del Re, G.; Ebert, K. H.; Feilitzsch, F. von; Ferrari, N.; Hampel, W.; Hartmann, F. X.; Henrich, E.; Heusser, G.; Kaether, F.; Kiko, J.; Kirsten, T.; Lachenmaier, T.; Lanfranchi, J.; Laubenstein, M.; Lützenkirchen, K.; Mayer, K.; Moegel, P.; Motta, D.; Nisi, S.; Oehm, J.; Pandola, L.; Petricca, F.; Potzel, W.; Richter, H.; Schoenert, S.; Wallenius, M.; Wojcik, M.; Zanotti, L. (2005). Complete results for five years of GNO solar neutrino observations. Physics Letters B, 616, 174–90. doi:10.1016/j.physletb.2005.04.068
Dahmen, N.; Griesheimer, P.; Makarczyk, P.; Pitter, S.; Walter, O. (2005). Solubility of trans-Co₂(CO)₆ [3,5-bis(CF₃)C₆H₃P(i-C₃H₇)₂] in dense carbon dioxide. Journal of Organometallic Chemistry, 690, 1467–73. doi:10.1016/j.jorganchem.2004.11.053
Kruse, A.; Krupka, A.; Schwarzkopf, V.; Gamard, C.; Henningsen, T. (2005). Influence of proteins on the hydrothermal gasification and liquefaction of biomass. 1. Comparison of different feedstocks. Industrial and Engineering Chemistry Research, 44, 3013–20. doi:10.1021/ie049129y
Hebach, A.; Martin, G.; Kögel, A.; Dahmen, N. (2005). Interfacial tension during mass transfer of CO₂ into water in a water-saturated CO₂ atmosphere at 298 K and 6.6 MPa. Journal of Chemical and Engineering Data, 50, 403–11. doi:10.1021/je049773j
Bluhm, M. E.; Folli, C.; Walter, O.; Döring, M. (2005). Nitrogen- and phosphorus-coordinated nickel(II) complexes as catalysts for the oligomerization of ethylene. Journal of Molecular Catalysis A: Chemical, 229, 177–81. doi:10.1016/j.molcata.2004.11.015
Hoffmann, T.; Pospiech, D.; Häussler, L.; Komber, H.; Voigt, D.; Harnisch, C.; Kollann, C.; Ciesielski, M.; Döring, M.; Perez-Graterol, R.; Sandler, J.; Altstädt, V. (2005). Novel phosphorous-containing aromatic polyethers - synthesis and characterization. Macromolecular Chemistry and Physics, 206, 423–31. doi:10.1002/macp.200400465
Bluhm, M. E.; Walter, O.; Döring, M. (2005). Chromium imine and amine complexes as homogeneous catalysts for the trimerisation and polymerisation of ethylene. Journal of Organometallic Chemistry, 690, 713–21. doi:10.1016/j.jorganchem.2004.09.080
Storzer, U.; Walter, O.; Zevaco, T.; Dinjus, E. (2005). (Cyclohexylmethylphenylphosphine)[(1-η¹:6-8-η³)-octa- 2,6-diene-1,8-diyl]palladium(II) as a model for key intermediates in enantioselective reactions of 1,3-butadiene catalyzed by palladium(0). Organometallics, 24, 514–20. doi:10.1021/om049595n
Ott, L.; Bicker, M.; Vogel, H.; Kruse, A. (2005). Einfluss von Natriumsulfat auf die Dehydratisierung von Polyolen in nah- und überkritischem Wasser. Chemie Ingenieur Technik, 77, 124–28. doi:10.1002/cite.200407081
Behrens, S.; Spittel, G. (2005). A new palladium nanoparticle catalyst on mesoporous silica prepared from a molecular cluster precursor. Dalton Transactions, (2005), 868–73. doi:10.1039/b415665j
Kruse, A.; Dinjus, E. (2005). Influence of salts during hydrothermal biomass gasification: the role of the catalysed water-gas shift reaction. Zeitschrift für physikalische Chemie, 219, 341–66. doi:10.1524/zpch.219.3.341.59177
Henrich, E. (2005). Hochwertige Synthesekraftstoffe aus Biomasse. Spiegel Der Wirtschaft Baden-Württemberg, (2005), 8–9.
Boukis, N.; Diem, V.; Galla, U.; D’Jesus, P.; Kruse, A.; Müller, H.; Dinjus, E. (2005). Wasserstofferzeugung aus Biomasse. Nachrichten - Forschungszentrum Karlsruhe, 37, 116–23.
Arnold, U.; Döring, M. (2005). Metalldotierte Hochleistungsduromere. Neue Katalysatoren für die Epoxidierung von Alkenen. Chemie Ingenieur Technik, GVC/DECHEMA Jahrestagungen 2005, Wiesbaden, 6.-8.September 2005, (Abstract), 77, 1207.
Behrens, S.; Habicht, W.; Unger, E. (2005). Nanometalle auf Biomolekülen. Nachrichten - Forschungszentrum Karlsruhe, 37, 69–73.
Patcas, F.; Hönicke, D. (2005). Effect of alkali doping on catalytic properties of alumina-supported nickel oxide in the selective oxidehydrogenation of cyclohexane. Catalysis Communications, 6, 23–27. doi:10.1016/j.catcom.2004.10.005
2004
Book Chapters
Behrens, S.; Unger, E. (2004). Nanostructural materials synthesized by deposition of metals on microtubule supports. Schwarz, J.A. [Hrsg.] Dekker Encyclopedia of Nanoscience and Nanotechnology New York, N.Y. : Marcel Dekker, 2004, 2563–70.
Behrens, S.; Dinjus, E.; Unger, E. (2004). Synthetic nanoinorganics by biomolecular templating. Nalwa, H.S. [Hrsg.] Encyclopedia of Nanoscience and Nanotechnology Stevenson Ranch, Calif.: American Scientific Publ., 2004 Vol.10, 381–92.
Doering, M.; Kollann, C.; Ciesielski, M. (2004). Halogen-free flame retardants in polymers. MoDeSt Workshop on Recycling of Polymeric Materials, Karlsruhe, July 3-4, 2003 Wissenschaftliche Berichte, FZKA-7005 (April 2004), C2/1–3.
Henrich, E.; Raffelt, K.; Stahl, R.; Weirich, F. (2004). Gasification of biomass. Agricultural residues to synfuel and power. MoDeSt Workshop on Recycling of Polymeric Materials, Karlsruhe, July 3-4, 2003 Wissenschaftliche Berichte, FZKA-7005 (April 2004), B5/1–18.
Journal Articles
Häber, T.; Kevorkiants, R.; Thiel, W.; Suhm, M. A. (2004). The performance of the semi-empirical AM1 method on small and nanometre-sized N₂O clusters. Phys. Chem. Chem. Phys., 6 (21), 4939–4949. doi:10.1039/B409258A
Watanabe, M.; Sato, T.; Inomata, H.; Smith, R. L.; Airai, K.; Kruse, A.; Dinjus, E. (2004). Chemical reactions of C₁ compounds in near-critical and supercritical water. Chemical Reviews, 104, 5803–21. doi:10.1021/cr020415y
Bluhm, M.; Albers, J.; Dinjus, E.; Döring, M. (2004). Reaktoreinsatz zum parallelen Testen homogener Katalysatoren. Chemie Ingenieur Technik, 76, 1672–75. doi:10.1002/cite.200403439
Guckian, A. L.; Doering, M.; Ciesielski, M.; Walter, O.; Hjelm, J.; O’Boyle, N. M.; Henry, W.; Browne, W. R.; McGarvey, J. J.; Vos, J. G. (2004). Assessment of intercomponent interaction in phenylene bridged dinuclear ruthenium(II) and osmium(II) polypyridyl complexes. Dalton Transactions, (2004), 3943–3949. doi:10.1039/b409189b
Lengsfeld, H.; Altstädt, V.; Döring, M.; Just, B.; Dittrich, U. (2004). Flame retardants: Flame-retardant epoxy resins. Kunststoffe / Plast Europe, 94, 300–04.
Ahlmann, M.; Walter, O. (2004). Syntheses and coordination behaviour of 2-(ortho-phosphinophenyl)-functionalised 1,3-dioxolanes and 1,3-dioxanes towards a [(COD)Rh]-complex fragment - models for immobilised complexes. Journal of Organometallic Chemistry, 689, 3117–31. doi:10.1016/j.jorganchem.2004.05.050
Agrofoglio, L. A.; Amblard, F.; Nolan, S. P.; Charamon, S.; Gillaizeau, I.; Zevaco, T. A.; Guenot, P. (2004). Synthesis of L-cyclopentenyl nucleosides using ring-closing metathesis and palladium-mediated allylic alkylation methodologies. Tetrahedron, 60, 8397–8404. doi:10.1016/j.tet.2004.07.009
Albers, J.; Dinjus, E.; Pitter, S.; Walter, O. (2004). High-pressure effects in the homogeneously catalyzed hydroformylation of olefins. Journal of Molecular Catalysis A: Chemical, 219, 41–46. doi:10.1016/j.molcata.2004.04.028
Behrens, S.; Wu, J.; Habicht, W.; Unger, E. (2004). Silver nanoparticle and nanowire formation by microtubule templates. Chemistry of Materials, 16, 3085–90. doi:10.1021/cm049462s
Hebach, A.; Oberhof, A.; Dahmen, N. (2004). Density of Water + Carbon Dioxide at Elevated Pressures: Measurements and Correlation. Journal of Chemical and Engineering Data, 49, 950–53. doi:10.1021/je034260i
Jansen, A.; Pitter, S. (2004). Homogeneously catalysed reduction of carbon dioxide with silanes: a study on solvent and ligand effects and catalyst recycling. Journal of Molecular Catalysis A: Chemical, 217, 41–45. doi:10.1016/j.molcata.2004.03.041
Apostolidis, C.; Morgenstern, A.; Walter, O.; Reddmann, H.; Amberger, H. D. (2004). Zur Elektronenstruktur metallorganischer Komplexe der f-Elemente. 60 [1] Strukturelle, einkristalloptische und magnetooptische Untersuchungen von Trialkylphosphat-Addukten des Grundkörpers Tris(cyclopentadienyl)lanthanid(III) (Ln = La, Pr) sowie Ergebnisse vergleichender optischer Studien an [Pr(Ind)₃(OP(OEt)₃)] (Ind = Indenyl). Zeitschrift für Anorganische und Allgemeine Chemie, 630, 928–42. doi:10.1002/zaac.200400044
Kögel, A.; Dahmen, N.; Ederer, H. (2004). Mass transfer coefficients from pendant water drop measurements in compressed carbon dioxide. Journal of Supercritical Fluids, 29, 237–49. doi:10.1016/S0896-8446(03)00071-8
Bürgstein, M. R.; Gamer, M. T.; Roesky, P. W. (2004). Nitrophenolate as a Building Block for Lanthanide Chains, Layers, and Clusters. Journal of the American Chemical Society, 126, 5213–18. doi:10.1021/ja0396044
Habicht, W.; Behrens, S.; Unger, E.; Dinjus, E. (2004). Scanning force and scanning electron microscopic/EDX investigations of microtubules serving as metallization templates. Microscopy and Microanalysis, Proc.of 2004, Savannah, Ga., August 1-5, 2004, Suppl.2, 10, 398–99. doi:10.1017/S1431927604882138
Bluhm, M. E.; Folli, C.; Döring, M. (2004). New iron-based bis(imino)pyridine and acetyliminopyridine complexes as single-site catalysts for the oligomerization of ethylene. Journal of Molecular Catalysis A: Chemical, 212, 13–18. doi:10.1016/j.molcata.2003.11.003
Balabanovich, A. I.; Zevaco, T. A.; Schnabel, W. (2004). Fire Retardance in Poly(butylene terephthalate). The Effects of Red Phosphorus and Radiation-Induced Cross-Links. Macromolecular Materials and Engineering, 289, 181–90. doi:10.1002/mame.200300153
Foxon, S. P.; Walter, O.; Koch, R.; Rupp, H.; Müller, P.; Schindler, S. (2004). Tuning the magnetic properties of a dinuclear copper complex: from ferromagnetic to antiferromagnetic coupling. European Journal of Inorganic Chemistry, (2004), 344–48. doi:10.1002/ejic.200300456
Foxon, S. P.; Torres, G. R.; Walter, O.; Pedersen, J. Z.; Toftlund, H.; Hüber, M.; Falk, K.; Haase, W.; Cano, J.; Lloret, F.; Julve, M.; Schindler, S. (2004). Syntheses, Structures, and Magnetic Properties of Copper(II) Complexes with 1,3-[Bis(2-pyridylmethyl)amino]benzene (1,3-tpbd) as Ligand. European Journal of Inorganic Chemistry, (2004), 335–43. doi:10.1002/ejic.200300426
Sinag, A.; Kruse, A.; Rathert, J. (2004). Influence of the heating rate and the type of catalyst on the formation of key intermediates and on the generation of gases during hydropyrolysis of glucose in supercritical water in a batch reactor. Industrial and Engineering Chemistry Research, 43, 502–08. doi:10.1021/ie030475+
Habicht, W.; Behrens, S.; Wu, J.; Unger, E.; Dinjus, E. (2004). Characterisation of metal decorated protein templates by scanning electron/scanning force microscopy and microanalysis. Surface and Interface Analysis, Proc.of the European Conf.on Applications of (ECASIA’03), Berlin, October 5-10, 2003, 36, 720–23. doi:10.1002/sia.1746
Dinjus, E.; Kruse, A. (2004). Hot compressed water - a suitable and sustainable solvent and reaction medium?. Journal of Physics: Condensed Matter, 19th AIRAPT 41st EHPRG Internat.Conf.on High Pressure Science and Technology, Bordeaux, F, July 7-11, 2003, Internat.Bunsen-Discussion ’Dynamics of Molecular Phenomena in Supercritical Fluids’, Tutzing, September 1-5, 2003, 16, 1161–69. doi:10.1088/0953-8984/16/14/026
Habicht, W.; Boukis, N.; Franz, G.; Dinjus, E. (2004). Investigation of nickel-based alloys exposed to supercritical water environments. Microchimica Acta, 8th European Workshop on Modern Developments and Applications in Microbeam Analysis (EMAS 2003), Chiclana de la Frontera, E, May 18-22, 2003, 145, 57–62. doi:10.1007/s00604-003-0127-9
Abeln, J.; Kluth, M.; Böttcher, M.; Sengpiel, W. (2004). Supercritical water oxidation (SCWO) using a transpiring wall reactor: CFD simulations and experimental results of ethanol oxidation. Environmental Engineering Science, 21st Internat.Conf.on Incineration and Thermal Treatment Technologies (IT3), New Orleans, La., May 13-17, 2002 Book of Abstracts S.8, S.93-99, 21. doi:10.1089/109287504322746794
Henrich, E.; Weirich, F. (2004). Pressurized entrained flow gasifiers for biomass. Environmental Engineering Science, Proc.of the 21st Annual Internat.Conf.on Incineration and Thermal Treatment Technologies (IT3), New Orleans, La., May 13-17, 2002 College Park, Md. : Univ.of Maryland, 2002 CD-ROM, 21, 53–64. doi:10.1089/109287504322746758
Henrich, E. (2004). Fast pyrolysis of biomass with a twin screw reactor. A first BTL step. PyNe Newsletter, (2004) Issue 17, 6–7.
Boukis, N.; Kruse, A.; Galla, U.; Diem, V.; Dinjus, E. (2004). Biomassevergasung in überkritischem Wasser. e.l.b.w. Umwelttechnik, Juli, 3, 42–43.
Patcas, F.; Maniut, C.; Pitter, S.; Dinjus, E. (2004). Beitrag zur Modellierung und Simulation des Hydroformylierungsprozesses. Chemie Ingenieur Technik, Dechema/GVC-Jahrestagungen, Karlsruhe, 12.-14.Oktober 2004, (Abstract), 76, 1353.
Patcas, F.; Makarczyk, P.; Maniut, C.; Pitter, S.; Dinjus, E. (2004). Innovative Katalysatorrückführung mittels überkritischem CO₂. Chemie Ingenieur Technik, Dechema/GVC-Jahrestagungen, Karlsruhe, 12.-14.Oktober 2004, (Abstract), 76, 1262.
2003
Journal Articles
Häber, T. (2003). FTIR-Spectroscopy of isolated and argon coated (HBr)
Bluhm, M. E.; Ciesielski, M.; Görls, H.; Walter, O.; Döring, M. (2003). Complexes of Schiff Bases and Intermediates in the Copper-Catalyzed Oxidative Heterocyclization by Atmospheric Oxygen. Inorganic chemistry, (2003), 42 (26), 8878–8885. doi:10.1021/ic034773a
Hebach, A.; Oberhof, A.; Dahmen, N.; Dinjus, E. (2003). Interfacial phenomena in the system water + CO2 + alcohol ethoxylates. Journal of Chemical and Engineering Data, 48, 1557–60. doi:10.1021/je034090+
Kruse, A.; Lietz, C. (2003). Measurement of residence time distribution in hot compressed water - first results obtained in a helical tube. Chemical Engneering and Technology, DECHEMA-Jahrestagung, Wiesbaden, 11.-13. Juni 2003, Poster, 26, 1119–1122. doi:10.1002/ceat.200303051
Doering, M.; Pufky, D.; Ciesielski, M. (2003). Copper-mediated cyclization and oxygenation of heterocyclic aldimines. Journal of inorganic Biochemistry, 96, 125.
Sinag, A.; Kruse, A.; Schwarzkopf, V. (2003). Aufbau- bzw. Abbaupfade von gebildeten Zwischenprodukten bei der Hydropyrolyse von Glucose als Modellsubstanz für nasse Biomasse im Rohrreaktor. Chemie Ingenieur Technik, 75, 1351–55. doi:10.1002/cite.200300054
Amberger, H. D.; Reddmann, H.; Schultze, H.; Jank, S.; Kanellakopulos, B.; Apostolidis, C. (2003). Zur Elektronenstruktur metallorganischer Komplexe der f-Elemente. Teil 54. Elektronische Raman- und f-f-Übergänge in den Tieftemperatur-Schwingungsspektren von Cp₃Ce(NCCH₃)₂. Spectrochimica Acta A, 59, 2527–39. doi:10.1016/S1386-1425(02)00419-5
Amberger, H. D.; Reddmann, H.; Guttenberger, C.; Unrecht, B.; Zhang, L.; Apostolidis, C.; Walter, O.; Kanellakopoulos, B. (2003). Spektroskopische und strukturelle Charakterisierung von Tris(2, 6-di-t-butyl-phenolato)lanthanid(III) (Ln(OAr’)₃; Ln = Pr, Nd) sowie parametrische Analyse des Kristallfeld-Aufspaltungsmusters von Nd(OAr’)₃. Zeitschrift für Anorganische und Allgemeine Chemie, 629, 1522–34. doi:10.1002/zaac.200300110
Kruse, A.; Henningsen, T.; Sinag, A.; Pfeiffer, J. (2003). Biomass gasification in supercritical water: Influence of the dry matter content and the formation of phenols. Industrial and Engineering Chemistry Research, 42, 3711–3717. doi:10.1021/ie0209430
Sinag, A.; Kruse, A.; Schwarzkopf, V. (2003). Key compounds of the hydropyrolysis of glucose in supercritical water in the presence of K₂CO₃. Industrial and Engineering Chemistry Research, 42, 3516–3521. doi:10.1021/ie030079r
Angermund, K.; Bühl, M.; Endruschat, U.; Mauschick, T.; Mörtel, R.; Mynott, R.; Tesche, B.; Waldöfner, N.; Bönnemann, H.; Köhl, G.; Modrow, H.; Hormes, J.; Dinjus, E.; Gassner, F.; Haubold, H. G.; Vad, T.; Kaupp, M. (2003). In situ study on the wet chemical synthesis of nanoscopic Pt colloids by "reductive stabilization". Journal of Physical Chemistry B, 107, 7507–7515. doi:10.1021/jp022615j
Xu, Q.; Wagner, K. D.; Dahmen, N. (2003). Vapor-liquid equilibria of different lactones in supercritical carbon dioxide. The journal of supercritical fluids, 26 (2), 83–93. doi:10.1016/S0896-8446(02)00157-2
Watanabe, M.; Osada, M.; Inomata, H.; Arai, K.; Kruse, A. (2003). Acidity and basicity of metal oxide catalysts for formaldehyde reaction in supercritical water at 673 K. Applied catalysis / A, 245 (2), 333–341. doi:10.1016/S0926-860X(02)00656-7
Wagner, K. D.; Dahmen, N.; Griesheimer, P. (2003). Salt effects on the partition coefficients of phenol in two-phase mixtures of water and carbon dioxide at pressures from (8 to 30) MPa at a temperature of 313 K. Journal of Chemical Thermodynamics, 35, 669–680. doi:10.1016/S0021-9614(02)00239-2
Langer, P.; Döring, M.; Seyferth, D.; Görls, H. (2003). Synthesis of nitrile oligomers through multiple anion capture reactions of allene dianions. European Journal of Organic Chemistry, (2003), 1948–1953.
Boukis, N.; Habicht, W.; Franz, G.; Dinjus, E. (2003). Behavior of Ni-base alloy 625 in methanol-supercritical water systems. Materials and Corrosion, 54, 326–330.
Weigl, M.; Müllich, U.; Geist, A.; Gompper, K.; Zevaco, T.; Stephan, H. (2003). Alkyl-substituted 2,6-dioxadiazolylpyridines as selective extractants for trivalent actinides. Journal of Radioanalytical and Nuclear Chemistry, 256, 403–12. doi:10.1023/A:1024531228330
Schatz, M.; Leibold, M.; Foxon, S. P.; Weitzer, M.; Heinemann, F. W.; Hampel, F.; Walter, O.; Schindler, S. (2003). Syntheses and characterization of copper complexes of the ligand (2-aminoethyl)bis(2-pyridylmethyl)amine (uns-penp) and derivatives. Dalton Transactions, (2003) 8, 1480–87. doi:10.1039/b208740e
Buchmüller, K.; Dahmen, N.; Dinjus, E.; Neumann, D.; Powietzka, B.; Pitter, S.; Schön, J. (2003). Control of homogeneously catalyzed reactions by phase equilibria. Green Chemistry, 5, 218–23. doi:10.1039/b212143n
Kruse, A.; Dinjus, E. (2003). Hydrogen from methane and supercritical water. Angewandte Chemie - International Edition, 42, 909–11.
Bujnowski, K.; Synoradzki, L.; Dinjus, E.; Zevaco, T.; Augustynowicz-Kope, E.; Zwolska, Z. (2003). Rifamycin antibiotics - new compounds and synthetic methods. Part 1: study of the reaction of 3-formylrifamycin SV with primary alkylamines of ammonia. Tetrahedron, 59 (11), 1885–1893. doi:10.1016/S0040-4020(03)00184-4
Boukis, N.; Diem, V.; Habicht, W.; Dinjus, E. (2003). Methanol reforming in supercritical water. Industrial and Engineering Chemistry Research, 42, 728–35. doi:10.1021/ie020557i
Kruse, A.; Gawlik, A. (2003). Biomass conversion in water at 330-410⁰C and 30-50 MPa. Identification of key compounds for indicating different chemical reaction pathways. Industrial and Engineering Chemistry Research, 42, 267–79. doi:10.1021/ie0202773
Holbrey, J. D.; Reichert, W. M.; Tkatchenko, I.; Bouajila, E.; Walter, O.; Tommasi, I.; Rogers, R. D. (2003). 1,3-dimethylimidazolium-2-carboxylate: the unexpected synthesis of an ionic liquid precursor and carbene-CO₂ adduct. Chemical Communications, (2003), 28–29. doi:10.1039/b211519k
Angermund, K.; Bühl, M.; Dinjus, E.; Endruschat, U.; Gassner, F.; Haubold, H. G.; Hormes, J.; Köhl, G.; Mauschick, F. T.; Modrow, H.; Mörtel, R.; Mynott, R.; Tesche, B.; Vad, T.; Waldöfner, N.; Bönnemann, H. (2003). Nanoscopic Pt colloids in the ’embryonic state’. Angewandte Chemie - International Edition, (2002), 41, 4041–44.
Dahmen, N. (2003). Komprimiertes Kohlendioxid - eine Alternative als Reinigungsmedium. Nachrichten - Forschungszentrum Karlsruhe, 35, 144–48.
Buchmüller, K.; Dahmen, N.; Neumann, D.; Pitter, S.; Powietzka, B.; Schön, J.; Storzer, U. (2003). Prozessentwicklung zu katalysierten Synthesen in lösungsmittelfreien Systemen. Nachrichten - Forschungszentrum Karlsruhe, 35, 133–38.
Ciesielski, M.; Döring, M.; Kollann, C. (2003). Halogenfreier Flammschutz für Kunststoffe. Nachrichten - Forschungszentrum Karlsruhe, 35, 128–32.
Böttcher, M.; Abeln, J. (2003). Schadstoffabbau in überkritischem Wasser - CFD-Simulation und Experiment im Schwitzwandreaktor. Nachrichten - Forschungszentrum Karlsruhe, 35, 111–16.
Boukis, N.; Kruse, A.; Galla, U.; Diem, V.; Dinjus, E. (2003). Biomassevergasung in überkritischem Wasser. Nachrichten - Forschungszentrum Karlsruhe, 35, 99–104.
Henrich, E.; Dinjus, E.; Raffelt, K.; Stahl, R.; Weirich, F. (2003). Synthesegas aus Biomasse. Nachrichten - Forschungszentrum Karlsruhe, 35, 92–98.
Dinjus, E. (2003). Innovative verfahrenstechnische Entwicklungen. Nachrichten - Forschungszentrum Karlsruhe, 35, 91.
2002
Journal Articles
Saito, Y.; Zevaco, T. A.; Agrofoglio, L. A. (2002). Chemical synthesis of ¹³C labeled anti-HIV nucleosides as mass-internal standards. Tetrahedron, (2002), 58 (47), 9593–9603. doi:10.1016/S0040-4020(02)01246-2
Browne, W. R.; O’Connor, C. M.; Hughes, H. P.; Hage, R.; Walter, O.; Doering, M.; Gallagher, J. F.; Vos, J. G. (2002). Ruthenium(II) and osmium(II) polypyridyl complexes of an asymmetric pyrazinyl- and pyridinyl-containing 1,2,4-triazole based ligand. Connectivity and physical properties of mononuclear complexes. Journal of the Chemical Society - Dalton Transactions, (2002), 4048–54. doi:10.1039/b206667j
Behrens, S.; Rahn, K.; Habicht, W.; Böhm, K. J.; Rösner, H.; Dinjus, E.; Unger, E. (2002). Nanoscale particle arrays induced by highly ordered protein assemblies. Advanced Materials, 14, 1621–25.
Börzel, H.; Comba, P.; Hagen, K. S.; Kerscher, M.; Pritzkow, H.; Schatz, M.; Schindler, S.; Walter, O. (2002). Copper-bispidine coordination chemistry: syntheses, structures, solution properties, and oxygenation reactivity. Inorganic Chemistry, 41, 5440–52. doi:10.1021/ic011114u
Apostolidis, C.; Rebizant, J.; Walter, O.; Kanellakopulos, B.; Reddmann, H.; Amberger, H. D. (2002). Zur Elektronenstruktur hochsymmetrischer Verbindungen der f-Elemente. 35 [1] Kristall- und Molekülstrukturen von Tris(hydrotris(1-pyrazolyl)borato)-lanthanid(III) (LnTp₃; Ln=La,Eu) sowie Elektronenstruktur von EuTp₃. Zeitschrift für Anorganische und Allgemeine Chemie, 628, 2013–25.
Kruse, A.; Lietz, C. (2002). Messung von Verweilzeitspektren in heissem Hochdruckwasser: Erste Ergebnisse im gewendelten Rohr. Chemie Ingenieur Technik, 74, 1140–44.
Bluhm, M. E.; Ciesielski, M.; Görls, H.; Döring, M. (2002). Copper-catalyzed oxidative heterocyclization by atmospheric oxygen. Angewandte Chemie - International Edition, 41, 2962–65.
Niklas, N.; Walter, O.; Hampel, F.; Alsfasser, R. (2002). Can aromatic interactions control the coordination geometry of zinc complexes? Structural evidence and a possible mechanism for the conversion of trigonal-bipyramidal to octahedral compounds. Journal of the Chemical Society - Dalton Transactions, (2002), 3367–73. doi:10.1039/b204125c
Kruse, A.; Dahmen, N.; Dinjus, E. (2002). Potential of pollutant treatment by combined extraction and oxidation with supercritical carbon dioxide. Chemical Engineering and Technology, 25, 882–85.
Pufky, D.; Beckert, R.; Döring, M.; Walter, O. (2002). A new synthesis of 1,2-diazetines via simple cycloacylation reactions. Heterocycles, 57, 1257–64.
Niklas, N.; Hampel, F.; Walter, O.; Liehr, G.; Alsfasser, R. (2002). Synthesis, structures, and redox properties of copper complexes with chiral and achiral amino acid derived ligands. European Journal of Inorganic Chemistry, (2002), (7), 1839–47.
Döring, M.; Ciesielski, M.; Walter, O.; Görls, H. (2002). Salicyldimine dizinc complexes: activation of water molecules and fixation of CO₂ in the coordination sphere of zinc. European Journal of Inorganic Chemistry, (2002), (7), 1615–21.
Limberg, C.; Hunger, M.; Habicht, W.; Kaifer, E. (2002). Synthesis of heterometallic bismuth/molybdenum alkoxides and their behavior on silica surfaces. Inorganic Chemistry, 41, 3359–65. doi:10.1021/ic011252j
Bekeredjian, R.; Behrens, S.; Ruef, J.; Dinjus, E.; Unger, E.; Baum, M.; Kuecherer, H. F. (2002). Potential of gold-bound microtubules as a new ultrasound contrast agent. Ultrasound in medicine & biology, 28 (5), 691–695. doi:10.1016/S0301-5629(02)00502-1
Bardas, M.; Dahmen, N.; Kraska, T.; Wagner, K. D.; Yelash, L. (2002). Isothermal vapor-liquid equilibria of binary systems of carbon dioxide and 1-butyne, compared to other binary CO₂+C₄Hsub(n) systems in terms of global parameters. Physical Chemistry Chemical Physics, 4, 987–91. doi:10.1039/b109059c
Billert, T.; Beckert, R.; Döring, M.; Wuckelt, J.; Fehling, P.; Görls, H. (2002). New heterocycles with cycloaminide substructure and their ringtransformation reactions with acetylene dicarboxylic ester. Journal of Heterocyclic Chemistry, (2001), 38, 205–12.
Langer, P.; Döring, M.; Schreiner, P. R.; Görls, H. (2002). Synthesis of radialene-shaped pyrroles by multiple-anion-capture reactions of 1,3-dianions. Chemistry - A European Journal, (2001), 7, 2617–27.
Langer, P.; Döring, M.; Seyferth, D.; Görls, H. (2002). Direct transformation of silyl enol ethers into functionalized allenes. Chemistry - A European Journal, (2001), 7, 573–84.
Langer, P.; Döring, M. (2002). Efficient synthesis of nitrogen heterocycles by cyclization of bis(nucleophiles) with oxaldiimidoyl dichlorides. European Journal of Organic Chemistry, (2002), 221–34.
Langer, P.; Anders, J. T.; Döring, M. (2002). One-pot synthesis of functionalized indoles by cyclization of lithiated amides and nitriles with oxaldiimidoyl dichlorides. European Journal of Organic Chemistry, (2001), 3953–59.
Langer, P.; Wuckelt, J.; Döring, M.; Schreiner, P. R.; Görls, H. (2002). Regioselective anionic [3+2] cyclizations of isoxazole, pyrazole and 1,2,4-triazole dinucleophiles. Efficient synthesis of 2,4-dihydroimidazo-[4,5-b]quinoxalines, 3H-imidazo[1,2-b]pyrazoles and 5H-imidazo[2,1-c]-[1,2,4]triazoles. European Journal of Organic Chemistry, (2001), 2257–63.
Langer, P.; Wuckelt, J.; Döring, M.; Schreiner, P. R.; Görls, H. (2002). Regioselective anionic [3+2] cyclizations of imidazole dinucleophiles with oxaldiimidoyl dichlorides. A combined experimental and theoretical study. European Journal of Organic Chemistry, (2001), 2245–55.
Langer, P.; Döring, M.; Görls, H. (2002). Regioselective synthesis of heterospirocyclic isobenzofuranones and medium-sized lactones by multiple anion capture reactions of 1,3-dianions. European Journal of Organic Chemistry, (2001), 1511–17.
Langer, P.; Wuckelt, J.; Döring, M.; Görls, H. (2002). Double anion capture reactions of anthranilic esters with oxaldiimidoyl dichlorides. Efficient synthesis of 2,2’-Biquinazoline-4,4’(3H,3’H)-diones. European Journal of Organic Chemistry, (2001), 1503–09.
Wuckelt, J.; Döring, M.; Görls, H.; Langer, P. (2002). Synthesis and properties of dimetallic complexes based on a new oxalamidine-derived ligand system with pendant pyridine functionality. European Journal of Inorganic Chemistry, (2001), 805–11.
Tumkevicius, S.; Agrofoglio, L. A.; Kaminskas, A.; Urbelis, G.; Zevaco, T. A.; Walter, O. (2002). Synthesis of a novel heterocyclic ring system: 2-thia-3,5,6,7,9-pentaazabenz[cd]azulenes. Tetrahedron letters, 43 (4), 695–697. doi:10.1016/S0040-4039(01)02222-5
Bühler, W.; Dinjus, E.; Ederer, H. J.; Kruse, A.; Mas, C. (2002). Ionic reactions and pyrolysis of glycerol as competing reaction pathways in near- and supercritical water. The journal of supercritical fluids, 22 (1), 37–53. doi:10.1016/S0896-8446(01)00105-X
Hebach, A.; Oberhof, A.; Dahmen, N.; Dinjus, E. (2002). Characterizing surfactants for usability in CO₂ surface treatment processes. Tenside Surfactants Detergents, Annual Meeting of the GDCh Special Group ’Waschmittelchemie (Detergent Chemistry)’, Würzburg, April 2-3, 2001,(2001), 38, 346–48.
Foxon, S. P.; Walter, O.; Schindler, S. (2002). Syntheses and Characterization of copper(II) complexes of the new ligands N-[(2-pyridyl)methyl]-2,2’-dipyridylamine and N-[bis(2-pyridyl)methyl]-2-pyridylamine. European Journal of Inorganic Chemistry, (2002), (1), 111–21.
Kruse, A.; Dahmen, N.; Dinjus, E. (2002). Möglichkeiten der Kombination von Extraktion und Oxidation mit überkritischem Kohlendioxid zur Schadstoffbehandlung. Chemie Ingenieur Technik, (2001), 73, 1443–47.
Henrich, E. (2002). Heu und Stroh: Zu schade für den Ofen. Kraftstoff und Strom aus aschereicher Biomasse. Erneuerbare Energien, (2002), (11), 51–52.
Wiegand, G.; Bürck, J.; Roth, S.; Mathieu, H.; Krämer, K. (2002). Combination of phase equilibria and NIR measurements in supercritical carbon dioxide for on-line process analysis. Chemical Engineering Transactions, Proc.of the 4th Internat.Symp.on High Pressure Process Technology and Chemical Engineering, Venezia, I, September 22-25, 2002, 2, 579–84.
2001
Book Chapters
Schulze, V.; Hornung, A.; Dahmen, N.; Hierl, F.; Tuerk, M.; Piotter, V. (2001). Entbinderung pulverspritzgegossener Bauteile mit überkritischem Kohlendioxid. Überkritische Fluide zur Behandlung und Herstellung komplexer Werkstoffe und Oberflächenstrukturen.
Journal Articles
Borho, N.; Häber, T.; Suhm, M. A. (2001). Chiral self-recognition in the gas phase: the case of glycidol dimers. Physical Chemistry Chemical Physics, 3 (11), 1945–1948. doi:10.1039/b102382a
Häber, T.; Schmitt, U.; Emmeluth, C.; Suhm, M. A. (2001). Ragout-jet FTIR spectroscopy of cluster isomerism and cluster dynamics: from carboxylic acid dimers to N₂O nanoparticles. Faraday Discussions, 118, 331–359. doi:10.1039/b009312m
Zimmermann, D.; Häber, T.; Schaal, H.; Suhm, M. A. (2001). Hydrogen bonded rings, chains and lassos: the case of t-butyl alcohol clusters. Molecular Physics, 99 (5), 413–425. doi:10.1080/00268970010017009
Schatz, M.; Becker, M.; Walter, O.; Liehr, G.; Schindler, S. (2001). Reactivity towards dioxygen of a copper(I) complex of tris(2-benzylaminoethyl)amine. Inorganica chimica acta, (2001), 324 (1-2), 173–179. doi:10.1016/S0020-1693(01)00588-6
Jacob, V.; Mann, S.; Huttner, G.; Walter, O.; Zsolnai, L.; Kaifer, E.; Rutsch, P.; Kircher, P.; Bill, E. (2001). Self-assembly of tetranuclear iron(II) compounds by a combination of rod- and clamp-shaped bridging units. European Journal of Inorganic Chemistry, (2001), (10), 2625–40.
Hell, K.; Stieglitz, L.; Dinjus, E. (2001). Mechanistic aspects of the de-novo synthesis of PCDD/PCDF on model mixtures and MSWI fly ashes using amorphous ¹²C- and ¹³C-labeled carbon. Environmental Science and Technology, 35, 3892–98. doi:10.1021/es0100266
Kritzer, P.; Dinjus, E. (2001). An assessment of supercritical water oxidation (SCWO). Existing problems, possible solutions and new reactor concepts. Chemical Engineering Journal, 83, 207–14.
Arico, E. M.; Zinner, L. B.; Kanellakopulos, B.; Dornberger, E.; Rebizant, J.; Apostolidis, C. (2001). Structure and properties of hydrated La(III), Nd(III) and Er(III) methanesulfonates. Journal of Alloys and Compounds, 323-324, 39–44.
Köster, F.; Dinjus, E.; Dunach, E. (2001). Electrochemical selective incorporation of CO₂ into terminal alkynes and diynes. European Journal of Organic Chemistry, (2001) No.13, 2507–11.
Ernst, C.; Walter, O.; Dinjus, E. (2001). Cp Ru-allylcarbene complexes by nucleophilic attack of cyclic Cp Ru-dicarbenes. Journal of Organometallic Chemistry, 627, 249–54.
Arakawa, H.; Aresta, M.; Armor, J. N.; Barteau, M. A.; Beckman, E. J.; Bell, A. T.; Bercaw, E.; Creutz, C.; Dinjus, E.; Dixon, D. A.; Domen, K.; Dubois, D. L.; Eckert, J.; Fujita, E.; Gibson, D. H.; Goddard, W. A.; Goodman, D. W.; Keller, J.; Kubas, G. J.; Kung, H. H.; Lyons, J. E.; Manzer, L. E.; Marks, T. J.; Morokuma, K.; Nicholas, K. M.; Periana, R.; Que, L.; Rostrup-Nielson, J.; Sachtler, W. M. H.; Schmidt, L. D.; Sen, A.; Somorjai, G. A.; Stair, P. C.; Stults, B. R.; Tumas, W. (2001). Catalysis research of relevance to carbon management: progress, challenges, and opportunities. Chemical Reviews, 101, 953–96. doi:10.1021/cr000018s
Schulz, H.; Reddmann, H.; Amberger, H. D.; Kanellakopulos, B.; Apostolidis, C.; Rebizant, J.; Edelstein, N. M. (2001). Zur Elektronenstruktur metallorganischer Komplexe der f-Elemente. LI. Synthese, Kristall-, Molekül- und Elektronenstruktur von Cp₃Nd(NCCH₃)₂. Journal of Organometallic Chemistry, 622, 19–32.
Hell, K.; Stieglitz, L.; Altwicker, E.; Addink, R.; Will, R. (2001). Reactions of 2,4,6-trichlorophenol on model fly ash: oxidation to CO and CO₂, condensation to PCDD/F and conversion into related compounds. Chemosphere, 42, 697–702.
Buekens, A.; Stieglitz, L.; Hell, K.; Huang, H.; Segers, P. (2001). Dioxins from thermal and metallurgical processes: recent studies for the iron and steel industry. Chemosphere, 42, 729–35.
Tascedda, P.; Weidmann, M.; Dinjus, E.; Dunach, E. (2001). Nickel-catalyzed electrochemical carboxylation of epoxides: mechanistic aspects. Applied Organometallic Chemistry, 5th Internat.Conf.on Carbon Dioxide Utilization (ICCDU V), Karlsruhe, September 5-10, 1999, 15, 141–44.
Schacht, M.; Boukis, N.; Dinjus, E. (2001). Corrosion of alumina ceramics in acidic aqueous solutions at high temperatures and pressures. Journal of Materials Science, (2000), 35, 6251–58.
Mätzing, H.; Baumann, W.; Becker, B.; Jay, K.; Paur, H. R.; Seifert, H. (2001). Adsorption of PCDD/F on MWI fly ash. Chemosphere, 6th Internat.Congress on Toxic Combustion Byproducts, Karlsruhe, June 27-30, 1999, 42, 803–09.
Weber, P.; Dinjus, E.; Stieglitz, L. (2001). The role of copper(II)chloride in the formation of organic chlorine in fly ash. Chemosphere, 6th Internat.Congress on Toxic Combustion Byproducts, Karlsruhe, June 27-30, 1999, 42, 579–82.
Wilhelm, J.; Stieglitz, L.; Dinjus, E.; Will, R. (2001). Mechanistic studies on the role of PAH’s and related compounds in PCDD/F formation on model fly ashes. Chemosphere, 6th Internat.Congress on Toxic Combustion Byproducts, Karlsruhe, June 27-30, 1999, 42, 797–802.
Habicht, W.; Behrens, S.; Boukis, N.; Dinjus, E. (2001). Scanning transmission type imaging and analysis (EDX) of protein supported metallic nanoparticles. Imaging and Microscopy, Special Issue of G.I.T. Laboratory Journal (2001), 42–44.
Boukis, N.; Schacht, M.; Dinjus, E. (2001). Werkstoffkorrosion in überkritischen wässrigen Lösungen. Nachrichten - Forschungszentrum Karlsruhe, 33, 81–90.
Kruse, A. (2001). Reaktionen in nah- und überkritischem Wasser. Nachrichten - Forschungszentrum Karlsruhe, 33, 59–70.
Bringmann, J.; Dinjus, E. (2001). Electrochemical synthesis of carboxyclic acids from alkenes using various nickel-organic mediators: CO₂ as C1-synthon. Applied Organometallic Chemistry, 5th Internat.Conf.on Carbon Dioxide Utilization (ICCDU V), Karlsruhe, September 5-10, 1999, 15, 135–40.
2000
Book Chapters
Kruse, A.; Abeln, J.; Dinjus, E.; Kluth, M.; Petrich, G.; Schacht, M.; Sadri, E.; Schmieder, H. (2000). Gasification of biomass and model compounds in hot compressed water. Manghnani, M.H. [Hrsg.] Science and Technology of High Pressure : Proc.of AIRAPT-17, Honolulu, Hawaii, July 25-30, 1999 Vol.2 S.954-57 Hyderabad : Universities Press, 2000 Dahmen, N.; Dinjus, E. [Hrsg.] High Pressure Chemical Engineering : Proc.of the Internat.Meeting of the GVC-Fachausschuß ’Hochdruckverfahrenstechnik’, Karlsruhe, March 3-5, 1999 Wissenschaftliche Berichte, FZKA-6271 (Juni 99) S.111-14.
Journal Articles
Raveendran, P.; Zimmermann, D.; Häber, T.; Suhm, M. A. (2000). Exploring a hydrogen-bond terminus: spectroscopy of eucalyptol–alcohol clusters. Physical Chemistry Chemical Physics, 2 (16), 3555–3563. doi:10.1039/b003024o
Schaal, H.; Häber, T.; Suhm, M. A. (2000). Hydrogen Bonding in 2-Propanol. The Effect of Fluorination. The Journal of Physical Chemistry A, 104 (2), 265–274. doi:10.1021/jp9928558
Vogel, B.; Corsmeier, U.; Vogel, H.; Fiedler, F.; Kühlwein, J.; Friedrich, R.; Obermeier, A.; Weppner, J.; Kalthoff, N.; Bäumer, D.; Bitzer, A.; Jay, K. (2000). Comparison of measured and calculated motorway emission data. Atmospheric Environment, 34, 2437–2450.
Tillack, A.; Trauthwein, H.; Hartung, C. G.; Eichberger, M.; Pitter, S.; Jansen, A.; Beller, M. (2000). Rhodium-Catalyzed Amination of Aromatic Olefins. Monatshefte für Chemie, (2000), 131 (12), 1327–1334. doi:10.1007/s007060070012
Zappe, J.; Wesch, A.; Ebert, K. H. (2000). Measurement of the mass transfer into single drops in the system of water/supercritical carbon dioxide. Journal of Colloid and Interface Science, 231, 1–7.
Kritzer, P.; Boukis, N.; Dinjus, E. (2000). Review of the corrosion of nickel-based alloys and stainless steels in strongly oxidizing pressurized high-temperature solutions at subcritical and supercritical temperatures. Corrosion, 56, 1093–1104.
Altmann, M.; Balata, M.; Belli, P.; Bellotti, E.; Bernabei, R.; Burkert, E.; Cattadori, C.; Cerichelli, G.; Chiarini, M.; Cribier, M.; D’Angelo, S.; Del Re, G.; Ebert, K. H.; Feilitzsch, F. von; Ferrari, N.; Hampel, W.; Handt, J.; Henrich, E.; Heusser, G.; Kiko, J.; Kirsten, T.; Lachenmaier, T.; Lanfranchi, J.; Laubenstein, M.; Motta, D.; Rau, W.; Richter, H.; Wänninger, S.; Wojcik, M.; Zanotti, L. (2000). GNO solar neutrino observations: results for GNO I. Physics Letters B, 490, 16–26.
Wagner, K. D.; Dahmen, N.; Dinjus, E. (2000). Solubility of triphenylphosphine, Tris(p-fluorophenyl)phosphine, Tris(pentafluorophenyl)phosphine, and Tris(p-trifluoromethylphenyl)phosphine in liquid and supercritical carbon dioxide. Journal of Chemical and Engineering Data, 45, 672–77.
Kritzer, P.; Boukis, N.; Dinjus, E. (2000). Transpassive dissolution of alloy 625, chromium, nickel, and molybdenum in high-temperature solutions containing hydrochloric acid and oxygen. Corrosion, 56, 265–72.
Jüttner, K.; Galla, U.; Schmieder, H. (2000). Electrochemical approaches to environmental problems in the process industry. Electrochimica Acta, 45, 2575–94.
Stahl, R.; Schön, J. (2000). Thermal behaviour of oil contaminated residues from metal cutting. Thermochimica Acta, 354, 15–19.
Walter, T.; Ederer, H. J.; Först, C.; Stieglitz, L. (2000). Sorption of selected polycyclic aromatic hydrocarbons on soils in oil-contaminated systems. Chemosphere, 41, 387–97.
Kruse, A.; Meier, D.; Rimbrecht, P.; Schacht, M. (2000). Gasification of Pyrocatechol in Supercritical Water in the Presence of Potassium Hydroxide. Industrial and engineering chemistry / Product research and development, 5th Internat.Symp.on Supercritical Fluids (ISSF), Atlanta, Ga., April 8-12, 2000,(2000), 39 (12), 4842–4848. doi:10.1021/ie0001570
Galla, U.; Kritzer, P.; Bringmann, J.; Schmieder, H. (2000). Process for total degradation of organic wastes by mediated electrooxidation. Chemical Engineering and Technology, 23, 230–33.
Kritzer, P.; Schacht, M.; Dinjus, E. (2000). The corrosion behaviour of nickel-base alloy 625 (NiCr22Mo9Nb; 2.4856) and ceria stabilized tetragonal zirconia polycrystal (Ce-TZP) against oxidizing aqueous solutions of hydrofluoric acid (HF), hydrobromic acid (HBr), and hydriodic acid (HI) at sub- and supercritical temperatures. Materials and Corrosion - Werkstoffe und Korrosion, (1999), 50, 505–16.
Schmieder, H.; Galla, U. (2000). Electrochemical processes for nuclear fuel reprocessing. Journal of Applied Electrochemistry, 30, 201–08.
Elsagir, A. R.; Gassner, F.; Görls, H.; Dinjus, E. (2000). Bidentate ferrocenylphosphines and their palladium(II)dichloride complexes. X-ray structural and NMR spectroscopic investigations and first results of their characteristics in the Pd-catalysed cooligomerisation of 1,3-butadiene with CO₂. Journal of Organometallic Chemistry, 597, 139–45.
Ernst, C.; Walter, O.; Dinjus, E.; Arzberger, S.; Görls, H. (2000). Structural characterization of Cp Ru-intermediates of phenylacetylene cyclotrimerization. Journal für praktische Chemie, (1999), 341, 801–04.
Schmieder, H.; Abeln, J. (2000). Supercritical water oxidation: state of the art. Chemical Engineering and Technology, (1999), 22, 903–11.
Henrich, E.; Bürkle, S.; Meza-Renken, Z. I.; Rumpel, S. (2000). Combustion and gasification kinetics of pyrolysis chars from waste and biomass. Journal of Analytical and Applied Pyrolysis, Pyrolysis ’98 : 14th Internat.Symp.on Analytical and Applied Pyrolysis, München, May 18-20, 1998,(1999), 49, 221–42.
Hell, K.; Altwicker, E. R.; Stieglitz, L.; Addink, R. (2000). Comparison of 2,4,6-trichlorophenol conversion to PCDD/PCDF on a MSWI-fly ash and a model fly ash. Chemosphere, 18th Symp.on Halogenated Environmental Organic Pollutants (DIOXIN ’98), Stockholm, S, August 17-21, 1998, 40, 995–1001.
Henrich, E. (2000). Verbrennung von heizwertarmen Feststoffen mit Sauerstoff. Nachrichten / Forschungszentrum Karlsruhe. FZKA-Nachrichten, 32 (3), 182–190.
1999
Book Chapters
Dahmen, N.; Schön, J.; Schmieder, H.; Dinjus, E. (1999). Cleaning of metal parts and components by compressed carbon dioxide. Dahmen, N.; Dinjus, E. [Hrsg.] High Pressure Chemical Engineering : Proc.of the Internat.Meeting of the GVC-Fachausschuß ’Hochdruckverfahrenstechnik’, Karlsruhe, March 3-5, 1999 Wissenschaftliche Berichte, FZKA-6271 (Juni 99), 301–04.
Schmieder, H.; Abeln, J. (1999). SCWO: facts and hopes. Dahmen, N.; Dinjus, E. [Hrsg.] High Pressure Chemical Engineering : Proc.of the Internat.Meeting of the GVC-Fachausschuß ’Hochdruckverfahrenstechnik’, Karlsruhe, March 3-5, 1999 Wissenschaftliche Berichte, FZKA-6271 (Juni 99), 83–88.
Boukis, N.; Friedrich, C.; Dinjus, E. (1999). Corrosion of titanium under SCWO-conditions. Recent results. Dahmen, N.; Dinjus, E. [Hrsg.] High Pressure Chemical Engineering : Proc.of the Internat.Meeting of the GVC-Fachausschuß ’Hochdruckverfahrenstechnik’, Karlsruhe, March 3-5, 1999 Wissenschaftliche Berichte, FZKA-6271 (Juni 99), 101–02.
Journal Articles
Häber, T.; Schmitt, U.; Suhm, M. A. (1999). FTIR-spectroscopy of molecular clusters in pulsed supersonic slit-jet expansions. Physical Chemistry Chemical Physics, 1 (24), 5573–5582. doi:10.1039/a907264k
Franck, E. U.; Wiegand, G.; Gerhardt, R. (1999). The density of hydrogen fluoride at high pressures to 973 K and 200 MPa. Journal of Supercritical Fluids, J. of supercrit. fluids 15 (1999) S. 127-133., 15, 127–34.
Reddmann, H.; Amberger, H. D.; Kanellakopulos, B.; Maiwald, S.; Taube, R. (1999). Zur Elektronenstruktur metallorganischer Komplexe der f-Elemente. XLVIII. Experimentelle Erfassung und parametrische Analyse der Elektronenstruktur von [Nd(η³-C₃H₅)₃.dioxan₂sub(/)₂] im f-Bereich. Journal of Organometallic Chemistry, 584, 310–17.
Kolarik, Z.; Müllich, U.; Gassner, F. (1999). Selective extraction of Am(III) over Eu(III) by 2,6-ditriazolyl- and 2,6-ditriazinylpyridines. Solvent Extraction and Ion Exchange, 17, 23–32.
Kolarik, Z.; Müllich, U.; Gassner, F. (1999). Extraction of Am(III) and Eu(III) nitrates by 2,6di-(5,6-dipropyl-1,2,4-triazin-3-yl) pyridines. Solvent extraction and Ion Exchange, 17, 1155–70.
Irngartinger, H.; Weber, A.; Escher, T.; Fettel, P. W.; Gassner, F. (1999). Synthesis of isoxazolo[60]fullerenes with dumb-bell-type structure and atropisomeric properties. European Journal of Organic Chemistry, (1999), 2087–92.
Ederer, H. J.; Kruse, A.; Mas, C.; Ebert, K. H. (1999). Modelling of the pyrolysis of tert-butylbenzene in supercritical water. Journal of Supercritical Fluids, 15, 191–204.
Kritzer, P.; Boukis, N.; Dinjus, E. (1999). The corrosion of nickel-base alloy 625 in sub- and supercritical aqueous solutions of oxygen: A long time study. Journal of Materials Science Letters, 18, 1845–47.
Kritzer, P.; Boukis, N.; Dinjus, E. (1999). Factors controlling corrosion in high-temperature aqueous solutions: a contribution to the dissociation and solubility data influencing corrosion processes. Journal of Supercritical Fluids, 15, 205–27.
Kritzer, P.; Boukis, N.; Dinjus, E. (1999). The corrosion of nickel-base alloy 625 in sub- and supercritical aqueous solutions of HNO₃ in the presence of oxygen. Journal of Materials Science Letters, 18, 771–73.
Friedrich, C.; Kritzer, P.; Boukis, N.; Franz, G.; Dinjus, E. (1999). The corrosion of tantalum in oxidizing sub- and supercritical aqueous solutions of HCl, H₂SO₄ and H₃PO₄. Journal of Materials Science, 34, 3137–41.
Mätzing, H.; Baumann, W.; Becker, B.; Jay, K.; Paur, H. R.; Seifert, H. (1999). Adsorption of chlorinated aromatics at fly ash particles. Journal of Aerosol Science, European Aerosol Conf., Praha, CZ, September 5-10, 1999, Suppl.1, 30, S779-S780.
Galla, U.; Kritzer, P.; Bringmann, J.; Schmieder, H. (1999). Verfahren zum Abbau von organischen Schadstoffen durch indirekte Elektrooxidation. Chemie Ingenieur Technik, 71, 628–33.
Wagner, K. D.; Brudi, K. H.; Dahmen, N.; Schmieder, H. (1999). Partition coefficients of aromatic organic substances in two-phase mixtures of water and carbon dioxide at pressures from 8 to 30 MPa and at temperatures of 313 to 333 K. Part II. The Journal of Supercritical Fluids, 15, 109–16.
Bechtler, R.; Stieglitz, L.; Zwick, G.; Will, R.; Roth, W.; Hedwig, K. (1999). Influence of elemental sulfur on the de-novo-synthesis of organochlorine compounds from residual carbon on fly ash. Chemosphere, (1998), 37, 2263–80.
Haack, V.; Dinjus, E.; Pitter, S. (1999). Synthesis of polymers with an intact lactone ring structure in the main chain. Angewandte Makromolekulare Chemie, (1998), 257, 19–22.
Schacht, M.; Boukis, N.; Dinjus, E.; Ebert, K.; Janssen, R.; Meschke, F.; Claussen, N. (1999). Corrosion of zirconia ceramics in acidic solutions at high pressures and temperatures. Journal of the European Ceramic Society, (1998), 18, 2373–76.
Kritzer, P.; Boukis, N.; Franz, G.; Dinjus, E. (1999). The corrosion of niobium in oxidizing sub- and supercritical aqueous solutions of HCl and H₂SO₄. Journal of Materials Science Letters, 18, 25–28.
Leitner, W.; Bühl, M.; Fornika, R.; Six, C.; Baumann, W.; Dinjus, E.; Kessler, M.; Krüger, C.; Rufinska, A. (1999). ¹⁰³Rh chemical shifts in complexes bearing chelating bidentate phosphine ligands. Organometallics, 18, 1196–1206.
Apostolidis, C.; Carvalho, A.; Domingos, A.; Kanellakopulos, B.; Maier, R.; Marques, N.; Pires de Matos, A.; Rebizant, J. (1999). Chloro-lanthanide, and plutonium complexes containing the hydrotris(3,5-dimethylpyrazol-1-yl)borate ligand: The crystal and molecular structures of [PrCl(μ-Cl)Tpsup(M)sup(e)₂(3,5-Me₂pzH)]₂ and YbCl₂Tpsup(M)sup(e)₂(THF). Polyhedron, (1998), 18, 263–72.
Comba, P.; Kanellakopulos, B.; Katsichtis, C.; Lienke, A.; Pritzkow, H.; Rominger, F. (1999). Synthesis and characterization of manganese(II) compounds with tetradentate ligands based on the bispidine backbone. Journal of the Chemical Society - Dalton Transactions, (1998), 3997–4001.
Arico, E. M.; Kanellakopulos, B.; Apostolidis, C.; Zinner, L. B. (1999). Synthesis and magnetic properties of (C₅H₅)₃Ce.HMPA. Journal of Alloys and Compounds, (1998), 275-277, 798–800.
Kritzer, P.; Boukis, N.; Dinjus, E. (1999). The corrosion of alloy 625 (NiCr22Mo9Nb; 2.4856) in high-temperature, high-pressure aqueous solutions of phosphoric acid and oxygen. Corrosion at sub- and supercritical temperatures. Materials and Corrosion, (1998), 49, 831–39.
Kruse, A.; Schmieder, H. (1999). Supercritical oxidation in water and carbon dioxide. Environmental Progress, (1998), 17, 234–39.
Huber, M.; Zürn, S. G.; Gassner, F.; Fehr, K. T. (1999). Einbau von Aluminium in 1.13 nm Tobermorit und die Auswirkungen auf die kristallchemischen Eigenschaften. Berichte der Deutschen Mineralogischen Gesellschaft, 76.Jahrestagung der Deutschen Mineralogischen Gesellschaft, Berlin, 6.- 9.Oktober 1998 : Referate der Vorträge und Poster, No.1, 1998 (Beihefte zum European Journal of Mineralogy, Vol. 10, 1998), 138.
Apostolidis, C.; Edelmann, F. T.; Kanellakopulos, B.; Reissmann, U. (1999). Organoactinide chemistry: polysilylated actinidocenes of thorium, uranium, and neptunium. Zeitschrift für Naturforschung B, 54, 960–62.
Behrens, S.; Dinjus, E.; Unger, E. (1999). Metallische Nanostrukturen auf der Basis hochgeordneter Proteine. Nachrichten - Forschungszentrum Karlsruhe, 31, 117–22.
Dahmen, N.; Dinjus, E. (1999). Trennprozesse mit überkritischem Kohlendioxid in der Umwelttechnik. GIT Fachzeitschrift für das Laboratorium, 43, 718–21.
Dahmen, N.; Schön, J.; Schmieder, H. (1999). Teilereinigung mit komprimiertem Kohlendioxid. Eine Alternative zu flüssigen Medien?. Galvanotechnik, 90, 1993–96.
1998
Book Chapters
Leitner, W.; Dinjus, E.; Gassner, F. (1998). CO₂ chemistry. Cornils, B. [Hrsg.] Aqueous-Phase Organometallic Catalysis : Concepts and Applications Weinheim : Wiley-VCH, 1998, 486–98.
Journal Articles
Hornung, A.; Bockhorn, H.; Hornung, U. (1998). Ein Kugelkreislaufreaktor zur Umsetzung viskoser Medien. Chemie - Ingenieur - Technik, 70 (3), 264–267. doi:10.1002/cite.330700307
Wörner, M.; Grötzbach, G. (1998). Pressure transport in direct numerical simulations of turbulent natural convection in horizontal fluid layers. The international journal of heat and fluid flow, 19 (2), 150–158. doi:10.1016/S0142-727X(97)10019-4
Stieglitz, L. (1998). Selected topics on the de novo synthesis of PCDD/PCDF on fly ash. Environmental Engineering Science, 15, 5–18.
Kritzer, P.; Boukis, N.; Dinjus, E. (1998). Corrosion of alloy 625 in high-temperature, high pressure sulfate solutions. Corrosion, 54, 689–99.
Kritzer, P.; Boukis, N.; Dinjus, E. (1998). Corrosion of alloy 625 in aqueous solutions containing chloride and oxygen. Corrosion, 54, 824–34.
Schneider, M.; Stieglitz, L.; Will, R.; Zwick, G. (1998). Formation of polychlorinated naphtalenes on fly ash. Chemosphere, 37, 2055–70.
Wagner, K. D.; Zappe, J.; Reeps, A.; Dahmen, N.; Dinjus, E. (1998). Vapor-liquid equilibria for the binary system of carbon dioxide and 1,3-butadiene at 303, 313 and 333 K. Fluid Phase Equilibria, 153, 135–42.
Hampel, W.; Heusser, G.; Kiko, J.; Kirsten, T.; Laubenstein, M.; Pernicka, E.; Rau, W.; Rönn, U.; Schlosser, C.; Wojcik, M.; Ammon, R. von; Ebert, K. H.; Fritsch, T.; Heidt, D.; Henrich, E.; Stieglitz, L.; Weirich, F.; Balata, M.; Hartmann, F. X.; Sann, M.; Bellotti, E.; Cattadori, C.; Cremonesi, O.; Ferrari, N.; Fiorini, E.; Zanotti, L.; Altmann, M.; Feilitzsch, F. von; Mössbauer, R.; Berthomieu, G.; Schatzmann, E.; Carmi, I.; Dostrovsky, I.; Bacci, C.; Belli, P.; Bernabei, R.; D’Angelo, S.; Paoluzi, L.; Bevilacqua, A.; Cribier, M.; Gosset, L.; Rich, J.; Spiro, M.; Tao, C.; Vignaud, D.; Boger, J.; Hahn, R. L.; Rowley, J. K.; Stoenner, R. W.; Weneser, J. (1998). Final results of the ⁵¹Cr neutrino source experiments in GALLEX. Physics Letters B, 420, 114–26.
Borwieck, H.; Walter, O.; Dinjus, E.; Rebizant, J. (1998). Organometallic chemistry in supercritical water: metallorganic products of the CpCo-catalyzed cyclotrimerization of acetylenes. Journal of Organometallic Chemistry, 570, 121–27.
Mätzing, H.; Baumann, W.; Becker, B.; Jay, K.; Paur, H. R.; Seifert, H. (1998). Gas/particle partitioning of chlorinated aromatics in waste incineration. Journal of Aerosol Science, Proc.of the 1998 Internat.Aerosol Conf., Edinburgh, GB, September 14-18, 1998, Suppl.1, 29, S449-S450.
Kritzer, P.; Boukis, N.; Dinjus, E. (1998). Über die transpassive Auflösung von Nickel-Basis-Legierungen und Edelstählen in sauerstoff- und chloridhaltigem Hochtemperatur-Wasser. Materials and Corrosion, (1997), 48, 799–805.
Leonhardt, E.; Stahl, R. (1998). Decomposition of acenaphthylene by ultrasonic irradiation. Analytical Chemistry, 70, 1228–30.
Franck, E. U.; Kerschbaum, S.; Wiegand, G. (1998). The density of toluene at high pressures to 673 K and 300 MPa. Berichte der Bunsengesellschaft für Physikalische Chemie, Ber. d. Bunsenges. f. Phys. Chem. 102 (1998) S. 1794-1797., 102 (12), 1794–97. doi:10.1002/bbpc.19981021208
Dahmen, N.; Schön, J.; Schmieder, H. (1998). Teilereinigung mit komprimiertem Kohlendioxid. Metalloberfläche, mo, 52, 438–40.
Dahmen, N.; Schön, J.; Schmieder, H. (1998). Reinigen mit komprimiertem Kohlendioxid. JOT - Journal für Oberflächentechnik, 38 (5), 56–57.
1997
Journal Articles
Angermund, K.; Baumann, W.; Dinjus, E.; Fornika, R.; Görls, H.; Kessler, M.; Krüger, C.; Leitner, W.; Lutz, F. (1997). Complexes [(P₂)Rh(hfacac)] as model compounds for the fragment [(P₂)Rh] and as highly active catalysts for CO₂ hydrogenation: the accessible molecular surface (AMS) model as an approach to quantifying the intrinsic steric properties of chelating ligands in homogeneous catalysis. Chemistry - A European Journal, 3, 755–64.
Jay, K.; Stieglitz, L. (1997). Interferences in the analysis of mixed halogenated dibenzofurans with diphenyl ethers. Chemosphere, 35, 1227–31.
Linardi, M.; Goldacker, H. (1997). Semi-empirical model for the continuous separation of aqueous entrainment by electric fields. Kerntechnik, 62, 172–77.
Kunert, M.; Dinjus, E.; Nauck, M.; Sieler, J. (1997). Structure and reactivity of sodium phenoxide. Following the course of the Kolbe-Schmitt reaction. European Journal of Inorganic Chemistry, 130, 1461–66.
Bringmann, J.; Ebert, K.; Galla, U.; Schmieder, H. (1997). Oxidative separation of nitrogen oxides from off-gases by electrochemical mediators. Journal of Applied Electrochemistry, 27, 870–72.
Linardi, M.; Goldacker, H. (1997). Semi-empirisches Modell für die kontinuierliche Abtrennung wässriger Fehlphasen mittels elektrischer Felder. Kerntechnik, 62, 172–77.
Linardi, M.; Goldacker, H. (1997). Experimentelle Untersuchung der Fehlphasenabscheidung aus Tri-n-butylphosphat mittels elektrischer Felder. Kerntechnik, (1996), 61, 168–72.
Linardi, M.; Goldacker, H. (1997). Continuous separation of aqueous entrainment from tri-n-butyl-phosphate by electric fields. Kerntechnik, 62, 25–33.
Wesch, A.; Dahmen, N.; Ebert, K.; Schön, J. (1997). Grenzflächenspannungen, Tropfengrößen und Kontaktwinkel im Zweiphasensystem H₂O/CO₂ bei Temperaturen von 298 bis 333 K und Drücken bis 30 MPa. Chemie Ingenieur Technik, 69, 942–46.
Liao, Y. P.; Haug, H. O. (1997). Investigation of stable coatings for in situ trapping of Se and Te in flow-injection hydride generation and graphite furnace atomic absorption spectrometry for automated determination. Microchemical Journal, 56, 247–58.
Apostolidis, C.; Deacon, G. B.; Dornberger, E.; Edelmann, F. T.; Kanellakopulos, B.; Mackinnon, P.; Stalke, D. (1997). Crystallisation and X-ray structures of [NaYb(C₅H₅)₃] and Yb(C₅H₅)₂. Chemical Communications, (1997), 1047–48.
Apostolidis, C.; Rebizant, J.; Kanellakopulos, B.; Ammon, R. von; Dornberger, E.; Müller, J.; Powietzka, B.; Nuber, B. (1997). Homoscorpionates (hydridotris(1-pyrazolyl)borato complexes) of the trivalent 4f ions. The crystal and molecular structure of [(HB(N₂C₃H₃))₃]₃Lnsup(I)sup(I)sup(I), (Ln=Pr,Nd). Polyhedron, 16, 1057–68.
Boukis, N.; Claussen, N.; Ebert, K.; Janssen, R.; Schacht, M. (1997). Corrosion screening tests of high-performance ceramics in supercritical water containing oxygen and hydrochloric acid. Journal of the European Ceramic Society, 17, 71–76.
Arico, E. M.; Zinner, L. B.; Apostolidis, C.; Dornberger, E.; Kanellakopulos, B.; Rebizant, J. (1997). Structures of the anhydrous Yb(III) and the hydrated Ce(III), Sm(III) and Tb(III) methanesulfonates. Journal of Alloys and Compounds, Proc.of the 21st Rare Earth Research Conf., Duluth, Minn., July 7-12, 1996, 249, 111–15.
Stieglitz, L.; Bautz, H.; Roth, W.; Zwick, G. (1997). Investigation of precursor reactions in the de-novo-synthesis of PCDD/PCDF on fly ash. Chlorinated Dioxins, PCB and Related Compounds : Proc.of the 15th Internat.Symp., Edmonton, CDN, August 21-25, 1995 Chemosphere, 34, 1083–90.
Schön, J.; Dahmen, N. (1997). Gebraucht ist noch nicht verbraucht. Abtrennung von Ölen aus Metallbearbeitungsrückständen. Schweizer Maschinenmarkt, (1997), (43), 28–30.
Goldacker, H.; Galla, U.; Kern, D. (1997). Rückbau der Plutoniumextraktionsanlage PUTE. Atomwirtschaft - Atomtechnik, 42, 387–92.
Dinjus, E.; Schmieder, H. (1997). Innovative Chemische Technik für die Entwicklung emissionsarmer Verfahren. Nachrichten - Forschungszentrum Karlsruhe, 29, 155–66.
Vehlow, J.; Wanke, T.; Seifert, H.; Jay, K.; Mark, F. E. (1997). Chlor- und bromhaltige Kunststoffe in der Abfallverbrennung. Nachrichten - Forschungszentrum Karlsruhe, 29, 147–54.
Gleiter, M. R.; Kanellakopulos, B.; Krieger, C.; Neugebauer, F. A. (1997). Intermolecular π-π interactions (pimerization) of tert-butyl-substituted phenazin-5(10H)-yl radicals in the solid state: syntheses, crystal structures and magnetic susceptibility measurements. Liebigs Annalen - Recueil - Organic and Bioorganic Chemistry, (1997), 473–84.
1996
Book Chapters
Franck, E. U.; Wiegand, G.; Dahmen, N. (1996). Water at high pressure and temperature. Ullmann’s Encyclopedia of Industrial Chemistry 5th Completely Rev.Ed. Weinheim [u.a.] : VCH Vol. A. Alphabetically Arranged Articles 28. Water to Zirconium and Zirconium Compounds 1996, 12–21.
Journal Articles
Ridder, D. J. A. de; Apostolidis, C.; Rebizant, J.; Kanellakopulos, B.; Maier, R. (1996). Tris(eta⁵-cyclopentadienyl)- phenolatoneptunium(IV). Acta Crystallographica C, 52, 1436–38.
Haug, H. O.; Liao, Y. P. (1996). Investigation of the automated determination of As, Sb, and Bi by flow-injection hydride generation using in-situ trapping on stable coatings in graphite furnace atomic absorption spectrometry. Fresenius’ Journal of Analytical Chemistry, 356, 435–44.
Stieglitz, L.; Neusüss, C.; Bautz, H.; Zwick, G. (1996). Ultraspurenanalytik durch hochauflösende Massenspektrometrie. Nachrichten - Forschungszentrum Karlsruhe, 28, 281–88.
Jay, K.; Stieglitz, L. (1996). Synthesis of mixed halogenated debenzofurans (X=Cl,Br). Chemosphere, 33, 1041–45.
Haug, H. O. (1996). Study on stable coatings for determination of lead by flow-injection hydride generation and in situ concentration in graphite furnace atomic absorption spectrometry. Spectrochimica Acta B, 51, 1425–33.
Brudi, K.; Dahmen, N.; Schmieder, H. (1996). Partition coefficients of organic substances in two-phase mixtures of water and carbon dioxide at pressures of 8 to 30 MPa and temperatures of 313 to 333 K. The Journal of Supercritical Fluids, 9, 146–51.
Wesch, A.; Dahmen, N.; Ebert, K. H. (1996). Measuring the static dielectric constants of pure carbon dioxide and carbon dioxide mixed with ethanol and toluene at elevated pressures. Berichte der Bunsengesellschaft, für Physikalische Chemie, 100, 1368–71.
Gallex Collaboration; Ammon, R. von; Ebert, K. H.; Fritsch, T.; Heidt, D.; Henrich, E.; Stieglitz, L.; Weirich, F. (1996). GALLEX solar neutrino observations: results for GALLEX III. Physics Letters B, 388, 384–96.
Kruse, A.; Ebert, K. H. (1996). Chemical reactions in supercritical water. 1. Pyrolysis of tert.-Butylbenzene. Berichte der Bunsengesellschaft, fuer Physikalische Chemie, 100, 80–83.
Ridder, D. J. A. de; Rebizant, J.; Apostolidis, C.; Kanellakopulos, B.; Dornberger, E. (1996). Bis(cyclooctatetraenyl)neptunium(IV). Acta Crystallographica C, 52, 597–600.
Henrich, E. (1996). GALLEX: Ergebnisse und Erfahrungen nach 5 Jahren Betrieb. Nachrichten - Forschungszentrum Karlsruhe, 28, 29–41.
Spirlet, M. R.; Rebizant, J.; Apostolidis, C.; Dornberger, E.; Kanellakopulos, B.; Powietzka, B. (1996). Oxo-bridged bimetallic organouranium complexes: the crystal structure of μ-oxo-bis[tris(cyclopentadienyl)- uranium(IV)]. Polyhedron, 15, 1503–08.
1995
Journal Articles
Bringmann, J.; Ebert, K.; Galla, U.; Schmieder, H. (1995). Electrochemical mediators for total oxidation of chlorinated hydrocarbons: formation kinetics of Ag(II), Co(III), and Ce(IV). Journal of Applied Electrochemistry, 25, 846–51.
Schön, J.; Dahmen, N.; Schmieder, H. (1995). Abfallbehandlung mit Kohlendioxid. Extraktion mit überkritischen Fluiden. Chemie-Anlagen und -Verfahren, (1994), 27 (10), 10–11.
Schön, J.; Dahmen, N. (1995). Öl aus Metall-Schleifschlämmen extrahieren. Umwelt, 25, 158.
Dahmen, N.; Schön, J.; Schmieder, H. (1995). Extraktive Abtrennung von Ölen aus Glas- und Metallbearbeitungsrückständen mit überkritischem Kohlendioxid. Chemie Ingenieur Technik, 67, 1501–04.
Gallex Collaboration; Ammon, R. von; Ebert, K.; Fritsch, T.; Heidt, D.; Henrich, E.; Schlosser, C.; Stieglitz, L.; Weirich, F. (1995). First results from the ⁵¹Cr neutrino source experiment with the GALLEX detector. Physics Letters B, 342, 440–50.
Gallex Collaboration; Ammon, R. von; Ebert, K.; Fritsch, T.; Heidt, D.; Henrich, E.; Stieglitz, L.; Weirich, F. (1995). GALLEX solar neutrino observations: complete results for GALLEX II¹̓²̓³̓⁴. Physics Letters B, 357, 237–47.
Fischer, E. O.; Apostolidis, C.; Dornberger, E.; Filippou, A. C.; Kanellakopulos, B.; Lungwitz, B.; Müller, J.; Powietzka, B.; Rebizant, J.; Roth, W. (1995). Carben- und Carbin-Komplexe des Technetiums und Rheniums. Synthese, Struktur und Reaktionen. Zeitschrift für Naturforschung, 50b, 1382–95.
Collina, E.; Lasagni, M.; Pitea, D.; Keil, B.; Stieglitz, L. (1995). Degradation of octachlorodibenzofuran and octachlorodibenzo-p-dioxin spiked on fly ash: kinetics and mechanism. Environmental Science and Technology, 29, 577–85.
Beran, M.; Stahl, R.; Beran, M. J. (1995). Glycaemic activity of chromium(III)-β-nicotinamide adenine dinucleotide phosphate complex and its presence in yeast extracts. 5th Nordic Symp.on Trace Elements in Human Health and Disease, Leon, N, June 19-22, 1994 Analyst, 120, 979–81.
Joachim, J. E.; Apostolidis, C.; Kanellakopulos, B.; Meyer, D.; Nuber, B.; Raptis, K.; Rebizant, J.; Ziegler, M. L. (1995). Metallorganische Chemie des Technetiums XII. Photolytische Co-Substitutionsreaktionen von Technetiumtricarbonylverbindungen. Synthesen und Röntgenstrukturanalysen von (C₅H₅)Tc(CO)₂(PPh₃) (C₅Me₅)Tc(CO)₂(PPh₃) und [HB(3,5-Me₂Pz)₃Tc(CO)₂[P(OMe)₃]] im Vergleich mit Homologen. Journal of Organometallic Chemistry, 492, 199–210.
Stahl, R. (1995). Routine determination of anions by capillary electrophoresis and ion chromatography. Journal of Chromatography A, (1994), 686, 143–48.
Jay, K.; Stieglitz, L. (1995). Identification and quantification of volatile organic components in emissions of waste incineration plants. Fiedler, H. [Hrsg.] DIOXIN ’94 : 14th Internat.Symp.on Chlorinated Dioxins, PCB and Related Compounds, Kyoto, J, November 21-25, 1994 Short Papers S.321-24 (Organohalogen Compounds ; 20) Chemosphere, S.1249-60, 30.
Dettmer, K.; Stieglitz, L. (1995). PARC - an automated apparatus for clean-up procedures used in routine-analysis for PCDD/PCDF and related compounds. Dioxin ’93-Symposium der Gesellschaft Oesterreichischer Chemiker, Wien, A, 20.-24.September 1993 Chemosphere,(1994), 29, 1789–96.
Leffrang, U.; Ebert, K.; Flory, K.; Galla, U.; Schmieder, H. (1995). Organic waste destruction by indirect electrooxidation. Separation Science and Technology, 8th Symp.on for Energy Applications, Gatlinburg, Tenn., October 24-28, 1993, 30, 1883–99.
1994
Journal Articles
Kremer, R. K.; Kanellakopulos, B.; Bele, P.; Brunner, H.; Neugebauer, F. A. (1994). Weak ferromagnetism and magnetically modulated microwave absorption at low magnetic fields in 1,3,5-triphenyl-6-oxoverdazyl. Chemical Physics Letters, 230, 255–59.
Kanellakopulos, B.; Ammon, R. von; Apostolidis, C.; Dornberger, E.; Maier, R.; Müller, J.; Zhang, X. (1994). Molekülstruktur und Ladungsverteilung in metallorganischen Verbindungen der f-Elemente. VII. Synthese und Untersuchungen von 1:1-Addukten zwischen Tris(cyclopentadienyl)Lanthanoid(III)- Verbindungen und Triethylphosphat. Journal of Organometallic Chemistry, 483, 193–204.
Gallex Collaboration; Ammon, R. von. (1994). Solar neutrino measurement with the radiochemical gallium detector (GALLEX). Astrophysics and Space Science, 214, 35–47.
Gallex Collaboration; Ammon, R. von. (1994). Status of the GALLEX solar neutrino experiment. Neues Jahrbuch für Mineralogie, Abhandlungen, 167, 155–67.
Gallex Collaboration. (1994). GALLEX results from the first 30 solar neutrino runs. Physics Letters B, 327, 377–85.
Neck, V.; Runde, W.; Kim, J. I.; Kanellakopulos, B. (1994). Solid-liquid equilibrium reactions of neptunium(V) in carbonate solution at different ionic strength. Radiochimica Acta, 65, 29–37.
Delapalme, A.; Raison, P.; Lander, G. H.; Rebizant, J.; Schweiss, P.; Kanellakopulos, B. (1994). Studies of U(C₅H₅)₃Cl: II-temperature dependence of the molecular configurations. Zeitschrift für Kristallographie, 209, 727–32.
Raison, P.; Rebizant, J.; Apostolidis, C.; Lander, G. H.; Delapalme, A.; Kiat, J. M.; Schweiss, P.; Kanellakopulos, B.; Gonthier-Vassal, A.; Brown, P. J. (1994). Studies of U(C₅H₅)₃Cl: I-evidence for structural phase transitions below room temperature. Zeitschrift für Kristallographie, 209, 720–26.
Joachim, J. E.; Apostolidis, C.; Kanellakopulos, B.; Meyer, D.; Raptis, K.; Rebizant, J.; Ziegler, M. L. (1994). Metallorganische Chemie des Technetiums. XI. Synthese, Charakterisierung und Röntgenstrukturanalyse von eta⁵-Tetra- methylazacyclopentadienyltechnetiumtri- carbonyl (Me₄C₄N)Tc(CO)₃ HNC₄Me₄ und seinen Mn- und Re-Homologen. Journal of Organometallic Chemistry, 476, 77–84.
Dahmen, N.; Schön, J.; Schwab, P.; Wilde, H.; Schmieder, H. (1994). Extraktive Abtrennung von Ölen aus Schleif- und Metallbearbeitungsrückständen mit überkritischen Fluiden. KfK-Nachrichten, 26, 128–32.
Raison, P.; Lander, G. H.; Delapalme, A.; Williams, J. H.; Kahn, R.; Carlile, C. J.; Kanellakopulos, B. (1994). Studies of U(C₅H₅)₃Cl: reorientational motions of cyclopentadienyl rings. Molecular Physics, 81, 369–83.
Atzkern, H.; Bergerat, P.; Fritz, M.; Hiermeier, J.; Hudeczek, P.; Kahn, O.; Kanellakopulos, B.; Köhler, F. H.; Ruhs, M. (1994). Dinuclear paramagnetic metallocenes bridged by silyl groups. Synthesis and intramolecular interactions. Chemische Berichte, 127, 277–86.
Wiegand, G.; Franck, E. U. (1994). Interfacial tension between water and non-polar fluids up to 473 K and 2800 bar. Berichte der Bunsengesellschaft, für Physikalische Chemie, 98, 809–17.
Maier, R.; Müller, J.; Kanellakopulos, B.; Apostolidis, C.; Domingos, A.; Marques, N.; Pires de Matos, A. (1994). Molecular structure and charge distribution in compounds of the 5f-elements - VI. 1:1 adducts of uranium(IV)-hydrotris(3,5- dimethylpyrazol-1-YL)borate-trichloride with Lewis bases. Polyhedron, (1993), 12, 2801–08.
Dettmer, K.; Michel, C. (1994). Automatisiertes Eindampfen in der Rückstandsanalytik. Einengen von Umweltproben mittels einer automatischen Eindampfstation. GIT Fachzeitschrift für das Laboratorium, (1993), 37, 877–78.
Dettmer, K.; Beck, J.; Götz, U.; Will, R.; Stieglitz, L. (1994). Automatic evaporation in PCDD/F- and chlorobenzene-routine-analysis. Chemosphere, (1993), 27, 2111–16.
Stahl, R. (1994). Ion chromatographic determination of chloride, chlorate, and perchlorate in sulfuric acid solutions. Chromatographia, (1993), 37, 300–02.
König, E.; Kanellakopulos, B.; Powietzka, B.; Nelson, J. (1994). Hysteresis models and their application to the spin-state transition in dithiocyanatobis (2,2’-bi-2-thiazoline)iron(II). Journal of Chemical Physics, (1993), 99, 9195–9201.