Publications
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
PhD Theses
Bernart, S. (2025, January 9). First Principle Investigations of the Activity of Pd and Pt Noble Metals in Varying Sizes Supported on Ceria. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000175624
Betz, M. (2025, July 7). Herstellung von benzinartigen Paraffinen aus Ethylen. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000182911
Chen, J. (2025, March 12). Structure and Composition of PtPd Model Catalysts under Operando Conditions. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000179829
Das, S. (2025, May 16). Multidimensional Morphological and Chemical Analysis of Heterogeneous Catalytic Systems using Hard X-ray Microscopy. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Gashnikova, D. (2025, April 24). Understanding reaction-induced dynamics of noble metal-based catalysts for emission control-applications by operando spectroscopy. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Kramarenko, A. S. (2025, March 25). Multi-Scale Modelling of Electrode-Electrolyte Interface: A Case Study on the Electrochemical Carboxylation of Benzyl Chloride. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000180266
Niethammer, B. (2025, April 10). Katalysator- und Prozessentwicklung zur Synthese aromatenarmer Kohlenwasserstoffgemische aus Dimethylether. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Perret, L. (2025, January 14). Experimental analysis of the influence of key process parameters on synthesis gas fermentation in continuous operation with Clostridium ljungdahlii. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000177709
Schmitt, C. (2025, April 24). Kontinuierliche Nanopartikelsynthese mit enger Partikelgrößenverteilung für katalytische Anwendungen. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Treu, P. (2025, February 6). Towards the oxidative cleavage of unsaturated fatty acids using zeolite catalysts. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Journal Articles
Abarca, J. A.; Warmuth, L.; Rieder, A.; Dutta, A.; Vesztergom, S.; Broekmann, P.; Irabien, A.; Díaz-Sainz, G. (2025). GDE Stability in CO
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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. (2025). opXRD: Open Experimental Powder X‐Ray Diffraction Database. Advanced Intelligent Discovery, 202500044. doi:10.1002/aidi.202500044
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
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
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
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
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
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
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
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
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
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
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
Sauer, J.; Wachsen, O. (2025). Zirkularität – Die Herausforderung des Chemieingenieurwesens. Chemie Ingenieur Technik, 97 (6), 588–598. doi:10.1002/cite.202500009
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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 x ‐based Catalysts for Efficient and Durable Propane Dehydrogenation. Angewandte Chemie International Edition. doi:10.1002/anie.202506704
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
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
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
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
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
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
Conference Papers
Arnold, U.; Drexler, M.; Fuchs, C.; Niethammer, B.; Sauer, J. (2025). Production of Fuels from Renewables via Methanol. Proceedings of the 2nd Cognitive Mobility Conference. Ed.: P. Baranyi, 218–227, Springer Nature Switzerland. doi:10.1007/978-3-031-87620-2_21
Reports/Preprints
Research Data
Wang, B.; Da Roit, N.; Schild, D.; Zimmermann, M.; Wang, Y.; Yu, Z.; Chen, S.; Behrens, S. (2025, February 13). Research data to "Single-Step Synthesis of Dimethyl Ether from Syngas over Nanoparticle-Derived Bifunctional Pd/CeO2/Al2O3 Catalysts". doi:10.35097/4jh897ny0tvjsa2e
Delrieux, T.; Sharma, S.; Maurer, F.; Czechowsky, J.; Borca, C. N.; Karpov, D.; Cardenas, C.; Lott, P.; Casapu, M.; Sheppard, T. L.; Grunwaldt, J.-D. (2025, July 8). Tracking Sulfur Poisoning of Pd/Al2O3 catalysts for methane oxidation on different complexity scales - Raw dat. doi:10.35097/ftrca4n1zbfbmjvy
Düll, A.; Lehmann, J.; Börnhorst, M.; Ates, C.; Häber, T.; Deutschmann, O. (2025, February 28). Spatio-temporal characterization of the three-dimensional wave dynamics in falling film flows over rectangular corrugations. doi:10.35097/96bzfuq5g04ydneq
Gojare, S.; Chen, S.; Chen, J.; Yu, Z.; Vazquez Quesada, J.; Pleßow, P. N.; Fink, K.; Wang, Y. (2025, April 3). Research data to "Adsorption of CO on α-Al2O3(0001): A combined experimental and computational study". doi:10.35097/sg9tcyz24sr4cv77
Grüger, T.; Studt, F. (2025, April 16). MC-Cluster: a Monte Carlo simulation for nanoparticle. doi:10.35097/pqmqcrq4h47eucz5
Savintseva, L.; Neugebauer, P. (2025, June 18). The electrochemical Shono oxidation of N-formylpyrrolidin: Mechanistic insights from the computational ferrocene electrode model and cyclic voltammetry: SI (after rev). doi:10.35097/yb7ufn2442ndv3vj
Savintseva, L.; Neugebauer, P. (2025, May 27). The electrochemical Shono oxidation of N-formylpyrrolidin: Mechanistic insights from the computational ferrocene electrode model and cyclic voltammetry: SI. doi:10.35097/bkb38p6juhxffxhp
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.; Saraci, E.; Grunwaldt, J.-D. (2025, February 13). Monitoring the Fate of Zn in the Cu/ZnO/ZrO2 Catalyst During CO2-to-Methanol Synthesis at High Conversions by Operando Spectroscopy - Raw Data. doi:10.35097/ncym5afk9q64kz8x
Struzek, S.; Delrieux, T.; Maurer, F.; Gonçalves, D. S.; Heck, S. L.; Klag, L.; Czechowsky, J.; Zimina, A.; Grunwaldt, J.-D. (2025, March 7). Role of powders and coatings - preliminary data. doi:10.35097/13dvc4pzw7v38xv5
Struzek, S.; Delrieux, T.; Maurer, F.; Gonçalves, D. S.; Heck, S.-L.; Klag, L.; Czechowsky, J.; Zimina, A.; Grunwaldt, J.-D. (2025, March 24). Role of powders and coatings for relating catalytic activity and structure of Pt in emission control catalysis - Raw data. doi:10.35097/urp37a5c07yzeeds
2024
PhD Theses
Eichner, F. (2024, April 29). Untersuchungen zur oxidativen Dehydrierung von Methanol zu Formaldehyd - Betrachtungen auf Katalysator- und Prozessebene. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000170290
Gierse, M. (2024, August 22). Development of a Power to Liquids Process for the Production of Dimethyl Ether by Dehydration of Methanol in a Reactive Distillation Column. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000173473
Huber, P. (2024, March 11). Dehydration and Decarboxylation Reactions in Brønsted and Lewis Acidic Zeolites. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000167714
Neukum, D. (2024, November 26). Catalyst development for the selective oxidation of crude 5-(hydroxymethyl)furfural in batch and continuous flow. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Robazza, A. (2024, August 12). Hybrid thermochemical-biological processes to enhance the energy recovery from waste. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000173292
Sheikh, K. A. (2024, April 19). Heterogen katalysierte Insertion von Kohlenstoffmonoxid in sauerstoffhaltige organische Verbindungen. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000165194
Spiske, L. F. (2024, March 19). Theoretical investigation of n-butane isomerization in metal-substituted aluminosilicates. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000168927
Trinkies, L. L. G. (2024, July 17). Untersuchungen zur Direktsynthese von Wasserstoffperoxid in mikrostrukturierten Membranreaktoren. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000169011
Wild, S. (2024, May 27). Untersuchung der Kinetik der einstufigen DME-Synthese unter variablem CO/CO2 Synthesegas für Scale-Up und Prozess-Optimierung. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000170570
Zimmermann, J. V. (2024, July 1). Optimization of the biocrude nitrogen content during the hydrothermal fractionation of municipal sewage sludge including pre- and post-treatments. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000172120
Journal Articles
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
Baehr, C.; Meyer Muñoz, T.; Raffelt, K.; Dahmen, N. (2024). Viscosity Reduction of Fast Pyrolysis Bio-Oil by Using CO
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
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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
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
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
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
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
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
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
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
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
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
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). Topological data analysis enhanced prediction of hydrogen storage in metal–organic frameworks (MOFs). Materials Advances, 2024 (5), 820–830. doi:10.1039/D3MA00591G
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
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
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
Smitshuysen, T. E. L.; Lützen, M.; Zimina, A.; Sheppard, T. L.; Jakobsen, H. H.; Chorkendorff, I.; Damsgaard, C. D. (2024). Using CoCu
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
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
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
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
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
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
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
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
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
Villagra-Soza, F.; Vergara, T.; Godoy, S.; Karelovic, A.; Jiménez, R. (2024). Unraveling the mechanistic interplay between CO and CO
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Conference Papers
Bala, E.; Hornung, U.; Dahmen, N. (2024). Adsorption Separation of Catechol, Accompanying Guaiacol and Phenol from the Hydrothermal Liquefaction (HTL) of Lignin. European Biomass Conference and Exhibition Proceedings, 769–771, ETA-Florence Renewable Energies.
Reports/Preprints
Mahayni, Y.; Maurer, L.; Baumeister, I.; Auer, F.; Wasserscheid, P.; Wolf, M. (2024). Batch and continuous synthesis of well-defined Pt/Al2O3 catalysts for the dehydrogenation of homocyclic LOHCs. ChemRxiv. doi:10.26434/chemrxiv-2024-slhhv
Presentations
Arnold, U.; Drexler, M.; Fuchs, C.; Niethammer, B.; Sauer, J. (2024, July 12). Fuels from methanol: Recent developments and perspectives. Satellite Conference of the 18th International Congress on Catalysis (C1Chem 2024), Lille, France, July 10–12, 2025.
Dutzi, J.; Boukis, N.; Sauer, J. (2024). Development of a novel reactor design for the process of supercritical water gasification to increase gasification efficiency and reduce solid deposition in the reaction system. Annual Meeting on Reaction Engineering and Electrochemical Processes (2024), Würzburg, Germany, May 6–8, 2024.
Dutzi, J.; Boukis, N.; Sauer, J. (2024). Development of a two-stream concept to increase the gasification efficiency of the SCWG process. 32nd European Biomass Conference and Exhibition (EUBCE 2024), Marseille, France, June 24–27, 2024.
Dutzi, J.; Vadarlis, A.; Boukis, N.; Sauer, J. (2024, July 30). Hydrothermal gasification: a pathway to renewable energy from contaminated biomass. ENERGY TRANSITION ON FARMS Renewable Sources and Electrification (Summer School 2024), Pieve Tesino, Italy, July 29–August 3, 2024.
Habes, C.; Bagheri, M.; Bodziony, F.; Wörner, M.; Marschall, H. (2024, June 26). phaseFieldFoam - A framework for multiphase flows using the phase field method. 5th International Conference on Numerical Methods in Multiphase Flows (ICNMMF 2024), Reykjavik, Iceland, June 26–28, 2024.
Schrader, W.; Mueller, D.; Düll, A.; Häber, T.; Stroh, A. (2024, June). Interfacial Mass Transfer Enhancement in Falling Films: Adjoint Topology Optimization with Volume-of-Fluid Method. 5th International Conference on Numerical Methods in Multiphase Flows (ICNMMF 2024), Reykjavik, Iceland, June 26–28, 2024.
Wörner, M. (2024, October 29). Analytical modeling of solute dispersion in laminar flow – bridging the gap between pure convection and axial dispersion regimes. 17th International Conference on Microreaction Technology (IMRET 2024), Graz, Austria, October 27–30, 2024.
Posters
Drexler, M.; Zaghini Francesconi, V.; Arnold, U.; Zevaco, T.; Sauer, J. (2024, March). Demonstration and evaluation of continuous, DME-based oxymethylene ether (OME) production in a liquid phase process. 57. Jahrestreffen Deutscher Katalytiker (2024), Weimar, Germany, March 13–15, 2024.
Drexler, M.; Zaghini Francesconi, V.; Fuchs, C.; Niethammer, B.; Arnold, U.; Herfet, M.; Sauer, J. (2024). Green methanol-based synthetic fuels for sustainable mobility. 11th Internationaler Motorenkongress (2024), Baden-Baden, Germany, February 27–28, 2025.
Dutzi, J.; Boukis, N.; Sauer, J. (2024). Parametric study of a novel reactor design developed for the process of supercritical water gasification. KNT-Symposium “Chemical Engineering for a Sustainable World” (2024), Karlsruhe, Germany, September 30–October 2, 2024.
Dutzi, J.; Boukis, N.; Sauer, J. (2024). Supercritical water gasification of contaminated biomasses. Final meeting and Final Project Event of H2020 project CERESiS (2024), Thessaloniki, Greece, April 23, 2024.
Dutzi, J.; Vadarlis, A.; Boukis, N.; Sauer, J. (2024). Investigation of Water Consumption in Supercritical Water Gasification of Ethanol. 32nd European Biomass Conference and Exhibition (EUBCE 2024), Marseille, France, June 24–27, 2024.
Ioannidou, G.; Drexler, M.; Arnold, U.; Sauer, J.; Lemonidou, A. A. (2024, July). Butadiene from biomass derivatives over Re-Mo based catalysts. 18th International Congress on Catalysis (ICC 2024), Lyon, France, July 14–19, 2024.
Lacerda de Oliveira Campos, B.; Beeskow, P.; Drexler, M.; Delgado, K. H.; Arnold, U.; Sauer, J. (2024, May). Kinetic modeling of the synthesis of poly(oxymethylene) dimethyl ethers (OME) from trioxane and dimethyl ether. Annual Meeting on Reaction Engineering and Electrochemical Processes (2024), Würzburg, Germany, May 6–8, 2024.
Münzer, P.; Arnold, U.; Sauer, J. (2024, June). Improving Overall Hydrogen Utilization by Direct Coupling of Methanol and Formaldehyde Production in a CO
Widmann, C.; Amersdorfer, M.; Biniyaminov, V.; Bründermann, E.; Doronkin, D.; Gethmann, J.; Grunwaldt, J. D.; Kolli, S. K.; Santamaria Garcia, A.; Sapronov, A.; Weidler, P.; Xu, C.; Zimina, A. V.; Müller, A.-S. (2024, May). Research Data Management and Data Flow in ROCK-IT. 15th International Particle Accelerator Conference (IPAC 2024), Nashville, TN, USA, May 19–24, 2024.
Zaghini Francesconi, V.; Drexler, M.; Arnold, U.; Sauer, J. (2024, May). Synthesis of oxymethylene ethers (OME) based on technical alcohol mixtures. Annual Meeting on Reaction Engineering and Electrochemical Processes (2024), Würzburg, Germany, May 6–8, 2024.
Research Data
Wang, B.; Zimmermann, M.; Da Roit, N.; Zevaco, T. (2024, November 5). Research data to "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". doi:10.35097/t01kkm2avytj8qbc
Das, S.; Kahnt, M.; van Valen, Y.; Bergh, T.; Venvik, H. J.; Sheppard, T. L. (2024, August 6). 2D reconstructions of Ag catalysts studied using in situ X-ray ptychography at P06 beamline, PETRA III, DESY. doi:10.35097/ebe9hsrmkpcwq5fv
Das, S.; Stuckelberger, M. E.; Pottbacker, J.; Jakobtorweihen, S.; Schroer, C. G.; Horn, R.; Sheppard, T. L. (2024, February 22). Resonant STXM-CT on single wire extracted from Pt/Rh gauzes treated under ammonia oxidation conditions for 50 days. doi:10.35097/1932
Das, S.; Stuckelberger, M. E.; Pottbacker, J.; Jakobtorweihen, S.; Schroer, C. G.; Horn, R.; Sheppard, T. L. (2024, February 22). Resonant STXM-CT on single wire extracted from Pt/Rh gauzes treated under ammonia oxidation conditions for 100 h. doi:10.35097/1931
Das, S.; Stuckelberger, M. E.; Pottbacker, J.; Jakobtorweihen, S.; Schroer, C. G.; Horn, R.; Sheppard, T. L. (2024, February 22). Resonant STXM-CT on single wire extracted from Pt/Rh gauzes treated under ammonia oxidation conditions for 50 h. doi:10.35097/1930
Das, S.; Stuckelberger, M. E.; Pottbacker, J.; Jakobtorweihen, S.; Schroer, C. G.; Horn, R.; Sheppard, T. L. (2024, February 22). Resonant STXM-CT on single wire extracted from Pt/Rh gauzes treated under ammonia oxidation conditions for 24 h. doi:10.35097/1929
De Campos, L.; Rex, A.; Gottschalk, T.; Sanchez, D. F.; Trinke, P.; Czioska, S.; Saraçi, E.; Bensmann, B.; Grunwaldt, J.-D.; Hanke-Rauschenbach, R.; Sheppard, T. L. (2024, May 29). Elemental Distribution in Catalyst-Coated Membranes of PEM Water Electrolysers Tracked by Synchrotron X-ray Fluorescence - Pristine CCM. doi:10.35097/CtiKQoyOgLCNsOBP
De Campos, L.; Rex, A.; Gottschalk, T.; Sanchez, D. F.; Trinke, P.; Czioska, S.; Saraçi, E.; Bensmann, B.; Grunwaldt, J.-D.; Hanke-Rauschenbach, R.; Sheppard, T. L. (2024, May 29). Elemental Distribution in Catalyst-Coated Membranes of PEM Water Electrolysers Tracked by Synchrotron X-ray Fluorescence - Fe2+ contaminated CCM. doi:10.35097/UhRarunqHJGutUVx
De Campos, L.; Rex, A.; Gottschalk, T.; Sanchez, D. F.; Trinke, P.; Czioska, S.; Saraçi, E.; Bensmann, B.; Grunwaldt, J.-D.; Hanke-Rauschenbach, R.; Sheppard, T. L. (2024, May 29). Elemental Distribution in Catalyst-Coated Membranes of PEM Water Electrolysers Tracked by Synchrotron X-ray Fluorescence - 100 h CV CCM. doi:10.35097/cjrGdnJmzvwVZRJZ
Delrieux, T.; Sharma, S.; Maurer, F.; Dolcet, P.; Lausch, M.; Zimina, A.; Cardenas, C.; Lott, P.; Casapu, M.; Sheppard, T.; Grunwaldt, J.-D. (2024, June 12). A laboratory scale fast feedback characterization loop for optimizing coated catalysts for emission control - Raw data. doi:10.35097/SIMRazQvMFmcyCnX
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, September 16). Lifecycle of Pd Clusters: Following the Formation and Evolution of Active Pd Clusters on Ceria During CO Oxidation by In Situ/Operando Characterization Techniques - raw data. doi:10.35097/0k5f6x56uxjsw7cw
Gashnikova, D.; Maurer, F.; Sauter, E.; Bernart, S.; Jelic, J.; Dolcet, P.; Maliakkal, C. B.; Wang, Y.; Wöll, C.; Studt, F.; Kübel, C.; Casapu, M.; Grunwaldt, J. D. (2024, July 16). Highly Active Oxidation Catalysts through Confining Pd Clusters on CeO2 Nano-Islands - raw data. doi:10.35097/PVkiykxrYcyhDLeP
Kahnt, M.; Das, S.; van Valen, Y.; Bergh, T.; Venvik, H. J.; Sheppard, T. (2024, August 6). 2D reconstructions of Ag catalysts studied using in situ X-ray ptychography at the NanoMAX beamline, MAX IV. doi:10.35097/prxrp7rx8rgfhdxu
Kramarenko, A. S.; Studt, F. (2024, July 12). Ab initio Kinetics of Electrochemical Reactions using Computational Ferrocenium Electrode - Simulation code. doi:10.35097/VKVYEoWBRxzhwiPh
Kramarenko, A. S.; Studt, F. (2024). Ab initio Kinetics of Electrochemical Reactions using Computational Ferrocenium Electrode - Simulation code. doi:10.35097/vkvyeowbrxzhwiph
Neukum, D.; Ludwig, M. E.; Uzunidis, G.; Lakshmi Nilayam, A. R.; Krause, B.; Behrens, S.; Grunwaldt, J.-D.; Saraçi, E. (2024, September 24). Raw data: Synergy of Ag and Pd in bimetallic catalysts for the selective oxidation of 5-(hydroxymethyl)furfural. doi:10.35097/zgsgqvm54xhvjdg8
Neukum, D.; Nilayam, A. R. L.; Ludwig, M. E.; Vadarlis, A. A.; Grunwaldt, J.-D.; Saraçi, E. (2024, March 1). Raw data: Continuous flow oxidation of HMF using supported AuPd-alloy. doi:10.35097/1938
Neukum, D.; Saraçi, E.; Krause, B.; Nilayam, A. R., Lakshmi; Sinigalia, A.; Grunwaldt, J.-D. (2024, January 17). Pushing the Efficiency of the Selective and Base-free Air-Oxidation of HMF by Varying the Properties of Carbon-based Supports - Raw data. doi:10.35097/1881
Schmitt, C.; Da Roit, N.; Neumaier, M.; Maliakkal, C. B.; Henrich, T.; Wang, D.; Kübel, C.; Kappes, M.; Behrens, S. (2024, March 13). Raw data for Continuous Flow synthesis of Atom-Precise Platinum Clusters. doi:10.35097/1955
Treu, P.; Gonçalves, D.; Raj Lakshmi Nilayam, A.; Grunwaldt, J.-D.; Saraci, E. (2024, July 5). Raw data for One-pot cascade reaction from epoxide to carboxylic acids using bifunctional Fe-ZSM-5. doi:10.35097/cPicihmYJUYScVRH
Treu, P.; Iltsiou, D.; Elbuga-Ilica, R.; Maliakkal, C. B.; Kegnæs, S.; Saraҫi E. (2024, September 11). Raw data for Enhancing the oxidative cleavage of vicinal diols on Fe-ZSM-5 catalysts with hierarchical porosity. doi:10.35097/3zyxt1k6687b1w8z
Weber, S.; Karpov, D.; Kahnt, M.; Diaz, A.; Romanenko, Y.; Kotrel, S.; Haas, A.; Hinrichsen, B.; Bottke, N.; Grunwaldt, J.-D.; Schunk, S. A.; Sheppard, T. (2024, August 6). X-ray fluorescence tomography dataset of propane dehydrogenation catalyst. doi:10.35097/712bnep20p9910bh
Weber, S.; Karpov, D.; Kahnt, M.; Diaz, A.; Romanenko, Y.; Kotrel, S.; Haas, A.; Hinrichsen, B.; Bottke, N.; Grunwaldt, J.-D.; Schunk, S. A.; Sheppard, T. (2024, August 6). Ptychographic tomography dataset of propane dehydrogenation catalyst. doi:10.35097/1f9hxh7bjebv7qtp
Audio & Video
Berger, J.; Herzinger, E.; Wolf, M. (2024). Rührversuche Dreiphasen-Slurry-Reaktor - 1500UPM-7cm-MitKat. doi:10.5445/IR/1000175684
Berger, J.; Herzinger, E.; Wolf, M. (2024). Rührversuche Dreiphasen-Slurry-Reaktor - 1500UPM-6cm-OhneKat. doi:10.5445/IR/1000175683
Berger, J.; Herzinger, E.; Wolf, M. (2024). Rührversuche Dreiphasen-Slurry-Reaktor - 1500UPM-6cm-MitKat. doi:10.5445/IR/1000175682
Berger, J.; Herzinger, E.; Wolf, M. (2024). Rührversuche Dreiphasen-Slurry-Reaktor - 1000UPM-7cm-MitKat. doi:10.5445/IR/1000175681
Berger, J.; Herzinger, E.; Wolf, M. (2024). Rührversuche Dreiphasen-Slurry-Reaktor - 1000UPM-6cm-OhneKat. doi:10.5445/IR/1000175680
Berger, J.; Herzinger, E.; Wolf, M. (2024). Rührversuche Dreiphasen-Slurry-Reaktor - 1000UPM-6cm-MitKat. doi:10.5445/IR/1000175679
Berger, J.; Herzinger, E.; Wolf, M. (2024). Rührversuche Dreiphasen-Slurry-Reaktor - 500UPM-7cm-MitKat. doi:10.5445/IR/1000175678
Berger, J.; Herzinger, E.; Wolf, M. (2024). Rührversuche Dreiphasen-Slurry-Reaktor - 500UPM-6cm-MitKat. doi:10.5445/IR/1000175677
Other
Yang, M.; Yu, J.; Zimina, A.; Sarma, B. B.; Grunwaldt, J.-D.; Zada, H.; Wang, L.; Sun, J. (2024, January 22). Inside Back Cover: Unlocking a Dual‐Channel Pathway in CO
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
PhD Theses
Amsler, J. (2023, May 3). Development of Anharmonic Molecular Models and Simulation of Reaction Kinetics in Zeolite Catalysis. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000158254
Baehr, C. (2023, February 14). Charakterisierung des Alterungsverhaltens von Pyrolyseöl sowie dessen Stabilisierung und Konditionierung mit Ethanol und verdichtetem CO₂. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000155830
Banivaheb, S. (2023, August 22). Integrated Microreactor System for One-stage Synthesis of Dimethyl Ether from Carbon Dioxide and Hydrogen. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000161161
Delgado Otalvaro, N. (2023, February 1). Semi-mechanistic, data-based, and hybrid models: A comprehensive comparison on the example of the direct DME synthesis from CO2-rich synthesis gas. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000155261
Fonseca, F. G. (2023, August 9). Process simulation and optimization of biomass fast pyrolysis. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000161174
Hakimioun, A. H. (2023, October 20). Theoretical Studies on the Influence of Size and Support Interactions of Copper Catalysts for CO2 Hydrogenation to Methanol. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000162772
Kövilein, A. (2023, June 26). From acetate to value-added products: L-malic acid production with Aspergillus oryzae. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000159501
Lacerda de Oliveira Campos, B. (2023, May 8). Multiscale modeling of the methanol synthesis: from surface reaction kinetics to techno-economic analysis. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000158433
Neuner, P. (2023, August 4). Hydroprocessing von synthetischen Wachsen zur Schmiermittelproduktion. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000161117
Pandit, L. (2023, May 25). Unravelling structural dynamics in Cu/ZnO-based methanol catalysts for future Power-to-Liquid applications. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Weber, S. (2023, July 17). Revealing Porosity and Structure of Ni-based Catalysts for Dynamic CO
Journal Articles
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
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
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.
Baehr, C.; Acar, R.; Hamrita, C.; Raffelt, K.; Dahmen, N. (2023). CO
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
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
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
Campos Fraga, M. M.; Vogt, J.; Lacerda de Oliveira Campos, B.; Schmitt, C. C.; Raffelt, K.; Dahmen, N. (2023). Investigation of Nb
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
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
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
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
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
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
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
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
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
Engl, T.; Langer, M.; Freund, H.; Rubin, M.; Dittmeyer, R. (2023). Tap Reactor for Temporally and Spatially Resolved Analysis of the CO
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Conference Papers
Alves, V. R. S.; Meyer, D. C.; Moreira, R.; Sousa, A. P. S.; Ushima, A. H.; Raffelt, K. (2023). Thermochemical Biomass Conversion Process in a Small-Scale Fluidized Bed Reactor: Fast Pyrolysis of Eucalyptus Wood and Gasification of Sugarcane Straw. European Biomass Conference and Exhibition Proceedings, 527 – 529, ETA-Florence Renewable Energies.
Arnold, U.; Drexler, M.; Fuchs, C.; Niethammer, B.; Sauer, J. (2023). Production of fuels from renewables via methanol. CogMob 2023, IEEE 2nd International Conference on Cognitive Mobility, Budapest, Hungary, October 19-20, 2023, Proceedings, 125–129, Institute of Electrical and Electronics Engineers (IEEE).
Gaur, A.; Paripsa, S.; Förste, F.; Doronkin, D.; Malzer, W.; Schlesiger, C.; Kanngießer, B.; Lützenkirchen-Hecht, D.; Welter, E.; Grunwaldt, J.-D. (2023). Metadata Fields and Quality Criteria - XAS Reference Database under DAPHNE4NFDI. Proceedings of the Conference on Research Data Infrastructure, 4 S., Technische Informationsbibliothek Open Publishing (TIB Open Publishing). doi:10.52825/CoRDI.v1i.258
Ioannidou, G.; Drexler, M.; Arnold, U.; Sauer, J.; Lemonidou, A. (2023). A sustainable catalytic process for the production of butadiene from waste biomass intermediates. KIT Science Week: Transforming towards a sustainable society – challenges and solutions, Karlsruhe.
Mello José, Á. H.; Raffelt, K.; Campos Fraga, M. M.; Schmitt, C. C.; Brambilla Rodrigues, R. de C. L.; Dahmen, N. (2023). Fast Pyrolysis and Catalytic Upgrading of Corncob Biomass for Fuel Production. European Biomass Conference and Exhibition Proceedings, 986–987, ETA-Florence Renewable Energies.
Muthukumar, K. V.; Ates, C.; Okraschevski, M.; Bürkle, N.; Aguirre Bermudez, D. M.; Haber, M.; Koch, R.; Bauer, H.-J.; Düll, A.; Öhl, F.; Häber, T.; Deutschmann, O. (2023). Interface enhancement with textured surfaces in thin-film flows. 17th SPHERIC International Workshop.
Telis, N. C.; Schmitt, C. C.; Raffelt, K.; Dahmen, N. (2023). Performance Evaluation of a Niobium-Based Pellet Catalyst: Hydrodeoxygenation of Bio-Oil in a Trickle Bed Reactor. European Biomass Conference and Exhibition Proceedings, 1007 – 1011, ETA-Florence Renewable Energies.
Reports/Preprints
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. (2023). A Comprehensive Assessment of Carbon Dioxide Removal Options for Germany. Authorea, Inc. doi:10.22541/essoar.170110442.26802720/v1
Heinzmann, P.; Glöser-Chahoud, S.; Schultmann, F.; Langenmayr, U.; Ruppert, M.; Fichtner, W.; Arnold, U.; Dahmen, N.; Fuchs, C.; Lam, H.; Graf, D.; Rauch, R.; Haas-Santo, K.; Dittmeyer, R.; Weyhing, T.; Wagner, U.; Andresh, M.; Haase, M.; Patyk, A.; Scheer, D.; Schmieder, L.; Kölle, C.; Landgraf, M.; Koch, T.; Sauer, J. (2023). Ergebnisbericht reFuels – Kraftstoffe neu denken. (O. Toedter, Ed.), Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000159935
Presentations
Arnold, U.; Drexler, M.; Fuchs, C.; Niethammer, B.; Sauer, J. (2023). Alternative fuels from renewables: The role of methanol. Helmholtz Energy Conference (2023), Koblenz, Germany, June 12–13, 2023.
Arnold, U.; Drexler, M.; Fuchs, C.; Niethammer, B.; Sauer, J. (2023). Paraffinic fuels from methanol. 11th International Conference Fuel Science - From Production to Propulsion (2023), Aachen, Germany, May 23–25, 2023.
Dutzi, J.; Boukis, N.; Sauer, J. (2023). Gasification of contaminated biomass under the conditions of supercritical water. 31st European Biomass Conference and Exhibition (EUBCE 2023), Bologna, Italy, June 5–8, 2023.
Fuchs, C.; Arnold, U.; Sauer, J. (2023). Production of gasoline and jet-fuel by heterogeneously catalyzed co-oligomerization of methanol-based olefins. Helmholtz Energy Conference (2023), Koblenz, Germany, June 12–13, 2023.
Klag, L.; Sheppard, T.; Grunwaldt, J.-D. (2023, March 16). Integral and spatially-resolved insights into structure and activity of mixed metal oxide catalysts during selective olefin oxidation. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Lacerda de Oliveira Campos, B.; Ferreira da Costa Junior, E.; Delgado, K. H.; Oliveira Souza da Costa, A.; Pitter, S.; Sauer, J. (2023, June 19). Application of machine-learning techniques to reproduce a microkinetic model for the methanol synthesis. 28th North American Meeting of the Catalysis Society (NAM 2023), Providence, RI, USA, June 18–23, 2023.
Lacerda de Oliveira Campos, B.; Ferreira da Costa Junior, E.; Herrera Delgado, K.; Oliveira Souza da Costa, A.; Pitter, S.; Sauer, J. (2023, March 17). Development of an artificial neural network to reproduce a microkinetic model for the methanol synthesis. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Moseev, D.; Ponomarenko, S.; Laqua, H. P.; Stange, T.; Nielsen, S. K.; Braune, H.; Gantenbein, G.; Illy, S.; Jelonnek, J.; Kasparek, W.; Kuleshov, A.; Krier, L.; Lechte, C.; Marsen, S.; Nishiura, M.; Plaum, B.; Ragona, R.; Ruess, T.; Salewski, M.; Stordiau, P.; Thumm, M.; Wolf, R. C.; Zimmermann, J.; W7-X Team. (2023, September). Commissioning and first results of the 174 GHz collective 5 Thomson scattering diagnostic at Wendelstein 7-X. 20th International Symposium on Laser-Aided Plasma Diagnostics (2023), Kyoto, Japan, September 10–14, 2023.
Sauer, J.; Drexler, M.; Fuchs, C.; Arnold, U. (2023). Methanol as key element for the production of fuels from renewable resources. 20th International Conference on Renewable Mobility "Fuels of the Future" (2023), Berlin, Germany, January 23–24, 2023.
Treu, P.; Sarma, B. B.; Saraçi, E. (2023, March 15). Impact of Fe speciation in Fe/MFI on the oxidative cleavage of vicinal diols. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Vergara, T.; Gómez, D.; Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Concepción, P.; Jiménez, R.; Karelovic, A. (2023, September). Kinetic and mechanistic study of CO2 conversion into methanol over Cu/TiO2 and Cu/SiO2 catalysts promoted by CeO2. 15th European Congress on Catalysis (EuropaCat 2023), Prague, Czechia, August 27–September 1, 2023.
Vergara, T.; Jiménez, R.; Delgado, K. H.; Lacerda de Oliveira Campos, B.; Karelovic, A. (2023, June). Kinetic and mechanistic study of CO2 conversion into methanol over Cu/TiO2 and Cu/SiO2 catalysts promoted by CeO2. 28th North American Meeting of the Catalysis Society (NAM 2023), Providence, RI, USA, June 18–23, 2023.
Vergara, T.; Pallacán, R.; Guevara, M.; Jiménez, R.; Karelovic, A. (2023, September). Structure sensitivity of methanol synthesis from CO2 on Cu/ZrO2 catalysts. 15th European Congress on Catalysis (EuropaCat 2023), Prague, Czechia, August 27–September 1, 2023.
Warmuth, L.; Guse, D.; Kind, M.; Steurer, M.; Schild, D.; Zimina, A.; Pitter, S. (2023, May 25). Green methanol from renewable feeds – Towards scalable catalyst synthesis and improved stability. 3rd Conference of the GDCh Division of Chemistry and Energy (2023), Pfinztal, Germany, May 24–25, 2023.
Wörner, M. (2023, March 29). Entwicklung einer universellen analytischen Beziehung für die maximale Ausbreitung eines Tropfens beim Aufprall auf eine Wand. Jahrestreffen der DECHEMA-Fachgruppen Aerosoltechnik (AT), Gasreinigung (GAS), Mehrphasenströmung (MPH) und Partikelmesstechnik (PMT 2023), Paderborn, Germany, March 28–30, 2023.
Zhao, D.; Gao, M.; Tian, X.; Doronkin, D.; Han, S.; Rodemerck, U.; Linke, D.; Ye, M.; Jiang, G.; Jiao, H.; Kondratenko, E. (2023, March 15). The effects of support in ZnOx/zeolite catalysts on the active species and product formation in propane and isobutane dehydrogenation. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Posters
Baumgarten, L.; Grunwaldt, J.-D.; Saraçi, E. (2023, March 16). Operando X-Ray Absorption Spectroscopic Investigations on Ni and Cu Catalysts for CO2-Hydrogenation. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Beichter, S.; Herfet, M.; Ordonez, M.; Rentschler, P. (2023). Sparkling DAC Decentralized, modular and flexibly operated Direct Air Capture Prototype. KIT Science Week / 4. Helmholtz Sustainability Summit (2023), Karlsruhe, Germany, October 10, 2023.
Czechowsky, J.; Dolcet, P.; Maliakkal, C.; Gross, S.; Behrens, S.; Kübel, C.; Grunwaldt, J.-D.; Casapu, M. (2023, March 15). Understanding the impact of the preparation method on the performance of Pt-Pd/γ-Al2O3 catalysts for emission control. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Da Roit, N.; Czechowsky, J.; Neumaier, M.; Wang, D.; Kappes, M.; Casapu, M.; Behrens, S. (2023, March 15). Powder model catalysts based on Pt clusters, Pt and Pd nanoparticles for emission control catalysis. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
De Oliveira, A.; Czechowsky, J.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D.; Wolf, M. (2023, March 15). One-pot synthesis of oxidation catalysts for emission control via solvent deficient precipitation. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Düll, A. (2023, June 22). Experimental and numerical investigation of the influence of surface structure modifications on the hydrodynamics of a falling film absorber. 19th Multiphase Flow Conference and Short Course -Simulation, Experiment and Application (2023), Dresden, Germany, June 19–23, 2023.
Düll, A. (2023, September 18). Influence of surface structure modification on CO2 absorption characteristics of a falling film absorber. 14th European Congress of Chemical Engineering (ECCE 2023), Berlin, Germany, September 17–21, 2023.
Dutzi, J.; Boukis, N.; Sauer, J. (2023). Separation of Heavy Metal Contaminants in the Process of Supercritical Water Gasification. 10th KIT-Zentrum Energie Promovierenden-Symposium // KIT Energy Center Doctoral Symposium (2023), Karlsruhe, Germany, May 10, 2023.
Dutzi, J.; Boukis, N.; Sauer, J. (2023). Hydrogen and methane production from ten biomasses in the process of supercritical water gasification. KIT Science Week / Zukunft gemeinsam nachhaltig gestalten (2023), Karlsruhe, Germany, October 10–15, 2023.
Elbuga-Ilica, R.; Zimina, A.; Serrer, M.; Saraçi, E.; Grunwaldt, J.-D. (2023, March 15). High pressure and long-term operando studies for production of sustainable fuels & chemicals: Bridging industry and synchrotron. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Kornetzky, K.; Schulte, M.; Maurer, F.; Jung, N.; Chacko, R.; Deutschmann, O.; Grunwaldt, J.-D. (2023, March 15). Towards research data management with an electronic lab notebook in catalysis. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Münzer, P.; Arnold, U.; Sauer, J. (2023). Directly Coupled Production of Methanol and Formaldehyde Based on CO
Münzer, P.; Arnold, U.; Sauer, J. (2023). Techno-Economic Comparison of Different Implementations of Coupled CH
Münzer, P.; Arnold, U.; Sauer, J. (2023). Techno-Economic Evaluation of Directly Coupled CH
Neukum, D.; Saraci, E.; Krause, B.; Sinigalia, A.; Nilayam, A. R., Lakshmi; Grundwaldt, J.-D. (2023, March 16). Rate enhancing effect of carbon support properties on Pt-catalyzed base-free HMF oxidation. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Niethammer, B.; Fuchs, C.; Arnold, U.; Sauer, J. (2023). Synthesis of low-aromatic hydrocarbon fuels from methanol or dimethyl ether. 10th International Engine Congress (2023), Baden-Baden, Germany, February 28–March 1, 2023.
Schmitt, C.; Czechowsky, J.; Casapu, M.; Behrens, S. (2023, March 15). Ceria supported mono- and bimetallic noble metal nanoparticles with narrow size distribution as model catalysts in emission control reactions. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Schulte, M.; Sender, V.; Baumgarten, L.; Saraçi, E.; Grunwaldt, J.-D. (2023, March 15). Impact of flame spray pyrolysis parameters on the structure and activity of Cu-based CO2-methanol catalysts. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Sharma, S.; Delrieux, T.; Karpov, D.; Grunwaldt, J.-D.; Sheppard, T. (2023, March 15). Visualising sulphur poisoning in structured catalysts with X-ray nanotomography. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Vergara, T.; Gómez, D.; Collins, S.; Jiménez, R.; Karelovic, A. (2023, June). Low contents of Zn on Cu/SiO2 modify the surface and the mechanism of CO2 hydrogenation to methanol. 28th North American Meeting of the Catalysis Society (NAM 2023), Providence, RI, USA, June 18–23, 2023.
Warmuth, L. (2023, March 15). Green methanol from renewable feeds : Towards scalable catalyst synthesis and improved stability. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Warmuth, L.; Guse, D.; Kind, M.; Steurer, M.; Zimina, A.; Grunwaldt, J.-D.; Schild, D.; Zevaco, T.; Pitter, S. (2023, June 19). Green methanol from renewable feeds : Towards scalable catalyst synthesis and improved stability. 28th North American Meeting of the Catalysis Society (NAM 2023), Providence, RI, USA, June 18–23, 2023.
Weber, S.; Diaz, A.; Karpov, D.; Kahnt, M.; Romanenko, Y.; Kotrel, S.; Grunwaldt, J.-D.; Schunk, S.; Sheppard, T. (2023, March 15). Probing Pore Accessibility of Coked Technical Catalysts by Hard X-ray Nanotomography. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Germany, March 15–17, 2023.
Research Data
Marchuk, V.; Sharapa, D. I.; Grunwaldt, J.-D.; Doronkin, D. E. (2023, October 17). Atomic coordinates of DFT-optimized Pt structures with O, N, and NHx species in surface or interstitial locations. doi:10.35097/1764
2022
PhD Theses
Araujo-Lopez, E. (2022, December 8). Theoretical Insights into the Light Alkanes Dehydrogenation and Aldehydes Hydrogenation on Transition Metal and Metal Oxide Surfaces. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000152395
Grandl, R. (2022, September 14). Simulation der Stoff- und Wärmetransportvorgänge bei der Schnellpyrolyse von Lignocellulose im Doppelschneckenmischreaktor. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000150483
Haltenort, P. (2022, March 3). Demonstration und Evaluation der kontinuierlichen und heterogenkatalysierten Synthese von Oxymethylendimethylethern (OME) aus Dimethylether und Trioxan. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000143343
Siebert, M. (2022, July 29). Intermetallische Verbindungen als Katalysatoren für die Semi-Hydrierung von Acetylen in mikrostrukturierten Reaktoren. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000149045
Zha, S. (2022, October 12). Hierarchical Multiscale Modelling of CoCu Catalyst in CO Hydrogenation : Bridge the Gap between Microscopic and Mesoscopic Systems. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000150313
Journal Articles
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
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
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
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
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
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
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
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
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
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
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
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
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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
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
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
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
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
Zheng, L.; Casapu, M.; Grunwaldt, J.-D. (2022). Understanding the multiple interactions in vanadium-based SCR catalysts during simultaneous NO
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
Conference Papers
Fuchs, C.; Arnold, U.; Sauer, J. (2022). Synthesis of sustainable, free of aromatics fuels by heterogeneously catalyzed oligomerization of renewable C
Ghosh Chowdhury, A.; Arnold, U.; Sauer, J. (2022). Synthesis of stable zinc oxide based catalysts for carrying out direct dehydrogenation of methanol to obtain (a) anhydrous formaldehyde and (b) highly selective hydrogen as by-product. Proceedings of the DGMK-Conference “The Role of Catalysis for the Energy Transition“, Ludwigshafen, October 5 -7 2022, 186–198, Deutsche Wissenschaftliche Gesellschaft für nachhaltige Energieträger, Mobilität und Kohlenstoffkreisläufe (DGMK).
Guse, D.; Warmuth, L.; Kreißig, F.; Pitter, S.; Kind, M. (2022). Preparation of Cu/Zn Based Catalyst Precursors – Importance of Thermodynamics and Seeding. The Role of Catalysis for the Energy Transition. DGMK-Event / Petrochemistry, 19–39, Deutsche Wissenschaftliche Gesellschaft für Erdöl, Erdgas und Kohle e.V. (DGMK).
Herfet, M. (2022). Experimental and Simulation Studies of Methanol and DME Synthesis from CO2-rich Syngas on Cu/ZnO/ZrO2 Catalysts. The Role of Catalysis for the Energy Transition, 3–18, Deutsche Wissenschaftliche Gesellschaft für Erdöl, Erdgas und Kohle e.V. (DGMK).
Schmitt, C. C.; Nguyen, K.; Schmitt, N.; Moreira, R.; Raffelt, K.; Hornung, U.; Dahmen, N. (2022). Platform chemicals from hydrothermal liquefaction of sugarcane bagasse and sugarcane straw. European Biomass Conference and Exhibition Proceedings, 30th European Biomass Conference and Exhibition, EUBCE 2022, Virtual, Online, 9th May 2022 - 12th May 2022, 951–953, ETA-Florence Renewable Energies.
Wörner, M.; Hornung, U.; Dahmen, N. (2022). Hydrothermal liquefaction of black liquor. European Biomass Conference and Exhibition Proceedings, 30th European Biomass Conference and Exhibition, EUBCE 2022, Virtual, Online, 9th May 2022 - 12th May 2022, 867–874, ETA-Florence Renewable Energies.
Reports/Preprints
Jurisic, A.; Stapf, D.; Delgado Otalvaro, N.; Herrera Delgado, K.; Sauer, J.; Klumpp, M.; Dittmeyer, R. (2022). Prozess 4.0 Ultraeffizienz und Digitalisierung. Teil 4: Ressourceneffizienz durch Digitalisierung in der Prozessindustrie - Abschlussbericht. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000150157
Wetzel, T. (2022). NAMOSYN – Nachhaltige Mobilität durch synthetische Kraftstoffe : Abschlussbericht. (P. Ruff, Ed.), Verbundvorhaben NAMOSYN.
Presentations
Arnold, U.; Drexler, M.; Fuchs, C.; Niethammer, B.; Sauer, J. (2022, December 19). Alternative liquid fuels from renewable resources: State of the art and perspectives. 19th International Conference on Renewable Mobility "Fuels of the Future" (2022), Online, January 24–28, 2022.
Bagheri, M.; Dadvand, A.; Wörner, M.; Marschall, H. (2022, July 14). A Unified Finite Volume Framework for Phase-field Simulations of Arbitraty Number of Immiscible Incompressible Fluids. 17th OpenFOAM Workshop (OFW 2022), Cambridge, United Kingdom, July 11–14, 2022.
Bagheri, M.; Wörner, M.; Marschall, H. (2022, March 18). Simulating an Arbitrary Number of Immiscible Fluids Using a Phase-Field Method: Development and Validation. Jahrestreffen der ProcessNet-Fachgruppen Computational Fluid Dynamics und Mischvorgänge und Agglomerations- und Schüttguttechnik (2022), Leipzig, Germany, March 16–18, 2022.
Bagheri, M.; Wörner, M.; Marschall, H. (2022, September 29). Drop impact onto a thin liquid film: extension from two to three phase scenarios using phase-field method. 4th International Conference on Numerical Methods in Multiphase Flows (ICNMMF-4 2022), Venice, Italy, September 28–30, 2022.
Barth, S.; Zengel, D.; Casapu, M.; Grunwaldt, J.-D. (2022, August 30). Formation of toxic HCN during NH3-SCR of alternative fuel engines. 12th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2022), Brussels, Belgium, August 29–31, 2022.
Behrendt, G.; Mockenhaupt, B.; Pandit, L.; Boubnov, A.; Saraçi, E.; Chowdhury, C.; Jelić, J.; Studt, F.; Grunwaldt, J.-D.; Behrens, M. (2022, June 28). Dynamics of SMSI in Cu/ZnO catalysts for methanol synthesis: Spectroscopic and theoretical insight from inverse catalysts. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Börnhorst, M.; Homan, T.; Rohlfs, P.; Deen, N. G.; Wörner, M. (2022, February 22). Charakterisierung der Zerteilungsdynamik von Blasen an Zylindern. Jahrestreffen der ProcessNet-Fachgruppen Mehrphasenströmungen, Mechanische Flüssigkeitsabtrennung sowie Zerkleinern und Klassieren (2022), Online, February 21–22, 2022.
Casapu, M.; Dolcet, P.; De Giacinto, A.; Maurer, M.; Czechowsky, J.; Maurer, F.; Gross, S.; Behrens, S.; Studt, F.; Türk, M.; Grunwaldt, J.-D. (2022, June 29). Noble metal particle size and support morphology effects on emission control by mono and bimetallic catalysts. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Chacko, R.; Shirsath, A. B.; Schulte, M. L.; Serrer, M.-A.; Stehle, M.; Angeli, S.; Gossler, H.; Saraçi, E.; Grunwaldt, J.-D.; Deutschmann, O. (2022, May 25). Spatially-Resolved Insights into Local Activity and Structure of Ni-Based CO₂ Methanation Catalyst in Fixed-Bed Reactors. 27th North American Meeting of the Catalysis Society (NAM 2022), New York, NY, USA, May 22–27, 2022.
Das, S.; Marchuk, V.; Sharma, S.; Doronkin, D.; Sanchez, D. F.; Grunwaldt, J.-D.; Sheppard, T. L. (2022, September 13). Chemical Gradients in Pt/Al2O3 and Cu-SSZ-13 Emission Control Catalysts Revealed by Operando XAS-tomography. 7th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VII 2022), Bad Herrenalb, Germany, September 11–13, 2022.
Dolcet, P.; Beck, F. M. A.; Casapu, M.; Grunwaldt, J.-D. (2022, September 5). tracking pt single sites on ceria using advanced operando x-ray techniques. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Dolcet, P.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D. (2022, August 30). Structural dynamics of highly dispersed Pt single sites supported on CeO2 for oxidation reactions. 12th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2022), Brussels, Belgium, August 29–31, 2022.
Doronkin, D. (2022, January 20). Operando XAS Probing Pd Catalysts in HIgh Pressure Chemical Reactors. GlobalXAS Journal Club (2022), Online, January 20, 2022.
Doronkin, D.; Deschner, B. J.; Wang, S.; Dittmeyer, R.; Behrens, S.; Grunwaldt, J.-D. (2022, June 8). Operando high pressure XAS and QEXAFS-XRD to study bimetallic Pd-based catalysts for the direct H2O2 synthesis. 19th Nordic Symposium on Catalysis (NSC 2022), Espoo, Finland, June 6–8, 2022.
Doronkin, D. E.; Becher, J.; Grunwaldt, J.-D.; Sheppard, T. L. (2022, August 29). Visualizing chemical gradients in a Cu-SSZ-13-washcoated honeycomb catalyst during NH3-SCR. 12th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2022), Brussels, Belgium, August 29–31, 2022.
Drexler, M.; Zaghini Francesconi, V.; Arnold, U.; Sauer, J. (2022). Catalytic transacetalization reactions for the modification of oxymethylene ether (OME) fuels. 28th Biennial ORCS Conference (2022), Jacksonville, FL, USA, October 16–20, 2022.
Fuchs, C.; Arnold, U.; Sauer, J. (2022). Effect of nickel loading on fuel production via heterogeneously catalyzed oligomerization of methanol-based olefins. (Bio-)Process Engineering - a Key to Sustainability (2022), Aachen, Germany, September 12–15, 2022.
Fuchs, C.; Arnold, U.; Sauer, J. (2022). Heterogeneously catalyzed oligomerization of renewable olefins as a pathway for the production of sustainable fuels. 10th International Conference Fuel Science - From Production to Propulsion (2022), Aachen, Germany, May 10–12, 2022.
Grunwaldt, J.-D. (2022, March 22). Catalysis for a clean and sustainable future: Dynamics on different time and complexity scales. European XFEL Science Seminar (2022), Hamburg, Germany, March 22, 2022.
Grunwaldt, J.-D. (2022, January). Research with Photons – Light for the Future, Committee “Research with Synchrotron Radiation”. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2022), Online, January 21–28, 2022.
Grunwaldt, J.-D. (2022, April 21). Designing and understanding heterogeneous catalysts for clean air and a sustainable future: The potential and role of synchrotron-based methods. GDCh-Kolloquium Chemie (2022), Kiel, Germany, April 21, 2022.
Keller, K.; Lott, P.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2022, May 27). Catalytic total oxidation of methane – Towards a better understanding of the water inhibition effect and the influence of the support material. 27th North American Meeting of the Catalysis Society (NAM 2022), New York, NY, USA, May 22–27, 2022.
Klag, L.; Sheppard, T. L.; Schmidt, M.; Horn, R.; Grunwaldt, J.-D. (2022, August 29). Spatially-resolved insights into activity and structure of mixed metal oxide catalysts during selective propylene and isobutene oxidation. 8th EuChemS Chemistry Congress (2022), Lisbon, Portugal, August 28–September 1, 2022.
Klag, L.; Sheppard, T. L.; Schmidt, M.; Horn, R.; Grunwaldt, J.-D. (2022, September 6). Spatially-resolved insights into structure-activity of mixed metal oxide catalysts during selective propylene and isobutene oxidation. 9th World Congress on Oxidation Catalysis (WCOC 2022), Cardiff, United Kingdom, September 4–8, 2022.
Kuhn, C.; Rohlfs, P.; Düll, A.; Tischer, S.; Börnhorst, M.; Deutschmann, O. (2022, July 20). Iron as recyclable metal fuel: Reaction kinetic analysis of iron oxide reduction with hydrogen. Jahrestreffen Reaktionstechnik (2022), Würzburg, Germany, July 18–20, 2022.
Lacerda de Oliveira Campos, B.; Herfet, M.; Rodrigues Niquini, G.; Wild, S.; Herrera Delgado, K.; Pitter, S.; Sauer, J. (2022, June 6). Multi-Scale Modeling of Methanol and Direct Dimethyl Ether Synthesis from CO2-rich Syngas. 19th Nordic Symposium on Catalysis (NSC 2022), Espoo, Finland, June 6–8, 2022.
Maurer, F.; Grunwaldt, J.-D. (2022, September 5). New opportunities of synchrotron light for unraveling dynamics and bridging the complexity scales in catalysis. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Maurer, F.; Lott, P.; Murzin, V.; Betz, B.; Votsmeier, M.; Vernoux, P.; Loridant, S.; Bornmann, B.; Frahm, R.; Deutschmann, O.; Casapu, M.; Grunwaldt, J.-D. (2022, January 25). Time and spatially resolved operando QEXAFS studies during activation of Pt/CeO2 for low tem-perature oxidation catalysis. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2022), Online, January 21–28, 2022.
Neukum, D.; Baumgarten, L.; Wüst, D.; Saraçi, E.; Kruse, A.; Grunwaldt, J.-D. (2022, June 7). Comparison of pure and bio-based HMF solution on the activity of noble metal based oxidation catalysts. 19th Nordic Symposium on Catalysis (NSC 2022), Espoo, Finland, June 6–8, 2022.
Perret, L.; Boukis, N.; Sauer, J. (2022, August). Biocatalytic COx-conversion to elementary building blocks. 26th International Congress of Chemical and Process Engineering (CHISA 2022), Prague, Czechia, August 21–25, 2022.
Pitter, S.; De Campos, L.; Guse, D.; Delgado, K. H.; Polierer, S.; Sauer, J.; Warmuth, L.; Wild, S.; Kind, M. (2022, June 7). Scalable synthesis of Cu-based catalysts as a tool for accelerated process development. 19th Nordic Symposium on Catalysis (NSC 2022), Espoo, Finland, June 6–8, 2022.
Sarma, B. B. (2022, May). Understanding Dynamics of Supported Atoms and Clusters with In-Situ/Operando Spectroscopy. 1st Conference of Applied Surface Chemistry (COAST 2022), Wiener Neustadt, Austria, May 16–17, 2022.
Serrer, M.-A.; Zimina, A.; Saraҫi E.; Loewert, M.; Pfeifer, P.; Grunwaldt, J.-D. (2022, March 30). High-pressure XAS & XRD infrastructure for operando catalytic studies at the synchrotron: A Fischer-Tropsch long-term experiment. 14th International Conference on Synchrotron Radiation Instrumentation (SRI 2022), Online, March 28–April 1, 2022.
Sheppard, T.; Becher, J.; Sanchez, D. F.; Doronkin, D.; Grunwaldt, J.-D. (2022, March 30). Sample environment for multimodal operando hard X-ray tomography of catalysts and functional materials. 14th International Conference on Synchrotron Radiation Instrumentation (SRI 2022), Online, March 28–April 1, 2022.
Treu, P.; Huber, P.; Plessow, P. N.; Studt, F.; Saraçi, E. (2022, March 25). Bio-terephthalate precursors via the Diels-Alder cycloaddition of isoprene and methyl acrylate over solid Lewis acid Sn-BEA zeolite. 33. Deutsche Zeolith-Tagung (2022), Frankfurt am Main, Germany, March 23–25, 2022.
Treu, P.; Saraçi, E.; Sarma, B. B.; Grunwaldt, J.-D. (2022, June 6). Oxidative C-C bond Cleavage of Vicinal Diols on Isolated Fe-sites in Fe/MFI catalysts. 19th Nordic Symposium on Catalysis (NSC 2022), Espoo, Finland, June 6–8, 2022.
Tusini, E.; Casapu, M.; Zimina, A.; Grunwaldt, J.-D. (2022, June 8). Operando X-Ray Absorption Spectroscopy of Bimetallic Catalysts for Methane Steam Reforming. 19th Nordic Symposium on Catalysis (NSC 2022), Espoo, Finland, June 6–8, 2022.
Vergara, T.; Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Jiménes, R.; Karolevic, A. (2022, September 19). Estudio cinético de la síntesis de metanol sobre catalizadores de cobre promovidos por óxido de cerio. XXVIII Congresso Ibero-Americano de Catálise (2022), Natal, Brazil, September 18–23, 2022.
Warmuth, L.; Pitter, S. (2022, June 30). Influence of impurities in H2 from different sources on the deactivation of methanol synthesis catalyst. Curiosity - A French German Young Chemists Conference (2022), Mulhouse, France, June 30–July 1, 2022.
Weber, S.; Abel, K.; Gläser, R.; Sheppard, T. (2022, June 27). Understanding of Catalyst Synthesis and Deactivation in 3D with X-ray Ptychography. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Weber, S.; Das, S.; Sharma, S.; Sheppard, T. (2022, September 6). New horizons for catalyst characterisation using hard x-ray tomography. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Weber, S.; Diaz, A.; Holler, M.; Schropp, A.; Lyubomirskiy, M.; Abel, K. L.; Kulkarni, S.; Keller, T.; Gläser, R.; Sheppard, T. L. (2022, March 29). High-resolution Imaging of the Calcination and Porosity Evolution of Ni/Al2O3 Catalysts by Ptychographic X-ray Microscopy. 14th International Conference on Synchrotron Radiation Instrumentation (SRI 2022), Online, March 28–April 1, 2022.
Weber, S.; Sheppard, T. L. (2022, August 30). 3D spatially-resolved catalyst characterization by X-ray tomography. 8th EuChemS Chemistry Congress (2022), Lisbon, Portugal, August 28–September 1, 2022.
Wollak, B.; Sheppard, T.; Espinoza, D.; Doronkin, D.; Sturm, M.; Dippel, A.; Gutowski, O.; Korup, O.; Schmidt, M.; Horn, R. (2022, June 27). Fixed-bed Reactor for Operando Structure-Activity Profiling. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Wollak, B.; Sheppard, T. L.; Doronkin, D. E.; Dippel, A.-C.; Sturm, M.; Gutowski, O.; Schmidt, M.; Korup, O.; Horn, R. (2022, March 31). Fixed-bed Reactor for Operando Spatially-Resolved Structure-Activity Profiling. 14th International Conference on Synchrotron Radiation Instrumentation (SRI 2022), Online, March 28–April 1, 2022.
Wollak, B.; Horn, R.; Dippel, A.-C.; Sturm, M.; Espinoza, D.; Gutowski, O.; Sheppard, T. L.; Doronkin, D.; Korup, O.; Schmidt, M. (2022, May 23). Fixed-Bed Reactor for Operando Structure-Activity Profiling. 27th North American Meeting of the Catalysis Society (NAM 2022), New York, NY, USA, May 22–27, 2022.
Wollak, B. M.; Doronkin, D. E.; Espinoza, D.; Sheppard, T.; Korup, O.; Schmidt, M.; Horn, R. (2022, March 30). Compact Profile Reactor for Structure-Activity Studies on Solid Catalysts by Spatially Resolved XAS, Concentration- and Temperature Profiling. 14th International Conference on Synchrotron Radiation Instrumentation (SRI 2022), Online, March 28–April 1, 2022.
Wörner, M. (2022, December 19). An energy balance model for the maximum spread diameter upon droplet impact on surfaces of arbitrary wettability. National Conference on Material Physics and Fluids (CPMF 2022), Oran, Algeria, December 18–19, 2022.
Zengel, D.; Barth, S.; Casapu, M.; Deutschmann, O.; Grunwaldt, J.-D. (2022, August 31). Opportunities and challenges of pre-turbine catalyst application. 12th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2022), Brussels, Belgium, August 29–31, 2022.
Zimmerlin, B.; Eberhard, M.; Dahmen, N.; Lam, H.; Mai, R.; Michelfelder, B.; Niebel, A.; Otto, T.; Pfitzer, C.; Willy, M.; Kolb, T.; Sauer, J.; Stapf, D. (2022, September). Operations of the bioliq® pilot plant - entrained flow gasification in 5 MW pilot scale. 2. Waste2H2-Workshop : Workshop and Summerschool (2022), KIT, September 19–26, 2022.
Posters
Bagheri, M.; Marschall, H.; Wörner, M. (2022, November 3). Impingement of E-Fuel droplets on a wall at elevated gas pressure : A numerical study on fluid dynamic similarity. 3rd International Workshop on Near-Wall Reactive Flows (2022), Darmstadt, Germany, November 3–4, 2022.
Bagheri, M.; Stumpf, B.; Roisman, I. V.; Tropea, C.; Hussong, J.; Wörner, M.; Marschall, H. (2022, September 26). Rotationally symmetric interaction of an impinging drop with a thin wall film of the same liquid – proposal of a benchmark case. 4th International Symposium on Multiscale Multiphase Process Engineering (MMPE 2022), Berlin, Germany, September 25–28, 2022.
Barth, S.; Zengel, D.; Casapu, M.; Grunwaldt, J.-D. (2022, June 28). Effects of HCHO presence during NOx reduction with NH₃. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Barth, S.; Zengel, D.; Casapu, M.; Grunwaldt, J.-D. (2022, September 12). Effects of HCHO presence during NOx reduction with NH3. 7th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VII 2022), Bad Herrenalb, Germany, September 11–13, 2022.
Baumgarten, L.; Neukum, D.; Saraçi, E.; Grunwaldt, J.-D. (2022, January 11). 5-(hydroxymethyl) furfural (HMF) as platform molecule from bio-based feedstocks for noble metal based selective oxidations. 758th WE-Heraeus Seminar (2022), Online, January 10–13, 2022.
Bertótiné Abai, A.; Tischer, S.; Deutschmann, O. (2022, September 11). Contribution of Urea and its Derivatives to Particulate Emission of Diesel Vehicles. 7th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VII 2022), Bad Herrenalb, Germany, September 11–13, 2022.
Börnhorst, M.; Homan, T. A. M.; Rohlfs, P.; Deen, N. G.; Wörner, M. (2022, September 27). Dynamics of bubble cutting by interaction with a solid cylinder. 4th International Symposium on Multiscale Multiphase Process Engineering (MMPE 2022), Berlin, Germany, September 25–28, 2022.
Boubnov, A.; Grunwaldt, J.-D. (2022, June 28). X-ray spectroscopy on zinc in methanol catalysts: using theory to understand experimental data. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Boubnov, A. (2022, January 11). X-Ray Spectroscopy on Zinc in Methanol Catalysts: Using Theory to Understand Experimental Data. 758th WE-Heraeus Seminar (2022), Online, January 10–13, 2022.
Braun, L.; Marchuk, V.; Doronkin, D.; Grunwaldt, J.-D. (2022, January 26). Iron as an energy source for a climate-neutral circular economy. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2023), Hamburg, Germany, January 23–27, 2023.
Chawla, J.; Schardt, S.; Angeli, S.; Lott, P.; Maier, L.; Tischer, S.; Deutschmann, O. (2022, June 27). Experimental & Modeling study of different reaction parameters on Oxidative Coupling of Methane over Pt/Al2O3. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Czioska, S. (2022, June 28). Operando Spectroscopy Investigations of Oxygen Evolution Catalysts at low and high Overpotentials. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Czioska, S.; Boubnov, A.; Escalera-Lopez, D.; Geppert, J.; Röse, P.; Saraçi, E.; Krewer, U.; Cherevko, S.; Grunwaldt, J.-D. (2022, January 10). Mechanistic and Structural Investigation of OER Catalysts by Oxygen Evolution Reaction at High Potentials Probed by Operando Spectroscopy. 758th WE-Heraeus Seminar (2022), Online, January 10–13, 2022.
Czioska, S.; Boubnov, A.; Saraçi, E.; Grunwaldt, J.-D. (2022, September 5). X-ray absorption spectroscopy of electrochemical catalysts under demanding conditions. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Das, S.; Marchuk, V.; Doronkin, D. E.; Sanchez, D. F.; Grunwaldt, J.-D.; Sheppard, T. (2022, June 28). Operando hard X-ray spectrotomography of Pt/Al2O3 and Cu-SSZ-13 zeolite emissions control catalysts. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Das, S.; Roeh, J. T.; Lyubomirskiy, M.; Galbierz, V.; Doehrmann, R.; Marx, R.; Schropp, A.; Schroer, C.; Sheppard, T. L. (2022, January 26). 2D in situ nanoreactor for catalyst characterization using hard X-rays and electron microscopy. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2022), Online, January 21–28, 2022.
Dolcet, P.; Giacinto, A. D.; Maurer, M.; Czechowski, J.; Maurer, F.; Gross, S.; Casapu, M.; Grunwaldt, J.-D. (2022, August 29). Systematic investigation on the effect of ceria morphology on the sintering and redispersion behavior of Pd and Pt nanoparticles. 12th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2022), Brussels, Belgium, August 29–31, 2022.
Doronkin, D.; Zheng, L.; Benzi, F.; Casapu, M.; Grunwaldt, J.-D. (2022, January 26). Probing redox and structural dynamics of V species in V-W-TiO
Drexler, M.; Arnold, U.; Sauer, J. (2022). Production and modification strategies for oxymethylene ethers (OME) as clean synthetic diesel substitutes. 9th Internationaler Motorenkongress (2022), Baden-Baden, Germany, February 22–23, 2022.
Eldridge, T.; Kale, S. S.; Dorokin, D.; Casapu, M.; Grunwaldt, J.-D. (2022, September 12). Catalytic Oxidation of Volatile Organic Compounds for Emission Reduction. 7th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VII 2022), Bad Herrenalb, Germany, September 11–13, 2022.
Escalera López, D.; Czioska, S.; Geppert, J.; Boubnov, A.; Röse, P.; Saraҫi E.; Krewer, U.; Grunwaldt, J.-D.; Guay, D.; Cherevko, S. (2022, January 10). Strategies to uncover activity-stability relationships in Ir-based catalysts for water splitting. 758th WE-Heraeus Seminar (2022), Online, January 10–13, 2022.
Fuchs, C.; Arnold, U.; Sauer, J. (2022). Effects of feed composition and pressure on the production of sustainable fuels by heterogeneously catalyzed oligomerization of C
Fuchs, C.; Arnold, U.; Sauer, J. (2022). Synthesis of sustainable fuels by heterogeneously catalyzed oligomerization of renewable C
Gashnikova, D.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D. (2022, August 29). Evolution of Pd single site catalysts supported on CeO2 under CO oxidation conditions monitored by operando XAS and DRIFT spectroscopy. 12th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2022), Brussels, Belgium, August 29–31, 2022.
Gaur, A.; Doronkin, D.; Paripsa, S.; Malzer, W.; Schlesiger, C.; Grunwaldt, J.-D.; Kanngiesser, B.; Lützenkirchen-Hecht, D. (2022, September 5). Xas reference database under DAPHNE4NFDI. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Gaur, A.; Høj, M.; Stehle, M.; Serrer, M.-A.; Stummann, M. Z.; Fontaine, C. L.; Briois, V.; Grunwaldt, J.-D. (2022, September 5). INVESTIGATING THE EFFECT OF REACTION CONDITION PARAMETERS ON THE REVERSIBLE S-O EXCHANGE AT THE ACTIVE SITES OF MoS2 BASED HYDROTREATING CATALYSTS BY ME-XAS. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Ghosh Chowdhury, A.; Arnold, U.; Sauer, J. (2022). Synthesis of stable zinc oxide based catalysts for carrying out direct dehydrogenation of methanol to achieve (a) anhydrous formaldehyde & (b) highly selective hydrogen as by-product. 9th Jahrestagung des KIT-Zentrums Energie (2022), Karlsruhe, Germany, June 14, 2022.
Ghosh Chowdhury, A.; Deutsch, D.; Arnold, U.; Sauer, J. (2022). Synthesis of stable zinc oxide based catalysts for carrying out direct dehydrogenation of methanol to achieve (a) anhydrous formaldehyde & (b) highly selective hydrogen as by-product. DGMK-Conference “The Role of Catalysis for the Energy Transition“ (2022), Ludwigshafen am Rhein, Germany, October 5–7, 2022.
Heck, S.-L.; Nails, G.; Dolcet, P.; Casapu, M.; Grunwaldt, J.-D. (2022, June 28). Systematic study on the impact of the gas atmosphere on the aging behavior of Pd/CeO2-ZrO2 three-way catalysts. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Heck, S.-L.; Nails, G.; Dolcet, P.; Orduz, H. A. S.; Glatzel, P.; Casapu, M.; Grunwaldt, J.-D. (2022, September 12). Understanding the aging behaviour of Pd based three-way catalysts. 7th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VII 2022), Bad Herrenalb, Germany, September 11–13, 2022.
Heck, S.-L.; Nails, G.; Dolcet, P.; Orduz, H. A. S.; Glatzel, P.; Casapu, M.; Grunwaldt, J.-D. (2022, August 29). Systematic investigation on the effect of noble metal precursor and gas atmosphere on the aging of Pd/CeO2-ZrO2 TWC. 12th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2022), Brussels, Belgium, August 29–31, 2022.
Hodonj, D.; Lott, P.; Tischer, S.; Deutschmann, O. (2022, September 11). Composition Modulation over Three-Way Catalysts. 7th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VII 2022), Bad Herrenalb, Germany, September 11–13, 2022.
Keller, K.; Lott, P.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2022, September 12). Catalytic total oxidation of methane – Towards a better understanding of the water inhibition effect and the influence of the support material. 7th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VII 2022), Bad Herrenalb, Germany, September 11–13, 2022.
Klag, L.; Stehle, M.; Sheppard, T.; Grunwaldt, J.-D. (2022, June 28). Monitoring the structural changes of Bi-Mo-Co-Fe-O catalysts during selective isobutene oxidation by complementary operando techniques. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Lacerda de Oliveira Campos, B.; Ferreira da Costa Junior, E.; Delgado, K. H.; Oliveira Souza da Costa, A.; Sauer, J. (2022, September 19). Simulation of the methanol synthesis with artificial neural networks. 10th Brazil Germany Symposium for Sustainable Development (2022), Niterói, Brazil, September 18–20, 2022.
Lacerda de Oliveira Campos, B.; Wild, S.; Pitter, S.; Sauer, J.; Herrera Delgado, K. (2022, July 18). Kinetic modeling and optimization of the methanol and dimethyl ether synthesis. Annual Meeting on Reaction Engineering and ProcessNet Subject Division Heat and Mass Transfer (2022), Würzburg, Germany, July 18–20, 2022.
Marchuk, V.; Doronkin, D. E.; Grunwaldt, J.-D. (2022, August 29). Operando QEXAFS study of diesel exhaust ammonia slip catalysts during realistic driving cycles. 12th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2022), Brussels, Belgium, August 29–31, 2022.
Marchuk, V.; Doronkin, D. E.; Grunwaldt, J.-D. (2022, March 30). Operando QEXAFS study of diesel exhaust ammonia slip catalysts during realistic driving cycles. 14th International Conference on Synchrotron Radiation Instrumentation (SRI 2022), Online, March 28–April 1, 2022.
Maurer, F.; Dolcet, P.; Gänzler, A.; Casapu, M.; Grunwaldt, J.-D. (2022, March 30). Tracking the evolution of Pt single site catalysts during CO oxidation using QEXAFS, HERFD-XANES and MCR-ALS as advanced tools. 14th International Conference on Synchrotron Radiation Instrumentation (SRI 2022), Online, March 28–April 1, 2022.
Maurer, F.; Struzek, S.; Delrieux, T.; Lott, P.; Casapu, M.; Deutschmann, O.; Grunwaldt, J.-D. (2022, August 29). Activation of Pt/CeO2 catalysts under applied conditions: from powder catalysts to monoliths. 12th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2022), Brussels, Belgium, August 29–31, 2022.
Montesano, L.; Lott, P.; Maier, L.; Tischer, S.; Angeli, S.; Deutschmann, O. (2022, September 11). Multiscale microkinetic modelling of carbon monoxide and methane oxidation over Pt/γ-Al2O3 catalyst. 7th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VII 2022), Bad Herrenalb, Germany, September 11–13, 2022.
Neukum, D.; Baumgarten, L.; Wüst, D.; Saraçi, E.; Kruse, A.; Grunwaldt, J.-D. (2022, June 28). Comparison of pure and bio-based HMF solution on the activity of noble metal based oxidation catalysts. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Pandit, L.; Boubnov, A.; Saraçi, E.; Grunwaldt, J.-D. (2022, June 28). Unraveling the Zn-Cu interaction on model Cu/MgO:ZnO methanol catalyst during activation by in-situ XAS. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Paripsa, S.; Lützenkirchen-Hecht, D.; Förste, F.; Malzer, W.; Schlesiger, C.; Kanngiesser, B.; Gaur, A.; Doronkin, D.; Kornetzky, K.; Grunwaldt, J.-D. (2022, January 26). XAS reference database under DAPHNE4NFDI. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2023), Hamburg, Germany, January 23–27, 2023.
Sarma, B. B.; Neukum, D.; Jelic, J.; Studt, F.; Grunwaldt, J.-D. (2022, June 28). Understanding Dynamics of Supported Atom with In-situ DRIFTS and XAS Spectroscopy. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Schropp, A.; Alizadehfanaloo, S.; Garrevoet, J.; Seyrich, M.; Murzin, V.; Wollak, B.; Horn, R.; Becher, J.; Doronkin, D. E.; Sheppard, T. L.; Grunwaldt, J.-D.; Schroer, C. G. (2022, January 26). Rapid XANES Imaging to Visualize Structural Changes in Catalysis. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2022), Online, January 21–28, 2022.
Schropp, A.; Döhrmann, R.; Botta, S.; Brückner, D.; Kahnt, M.; Lyubomirskiy, M.; Ossig, C.; Scholz, M.; Seyrich, M.; Stückelberger, M.; Wiljes, P.; Wittwer, F.; Garrevoet, J.; Falkenberg, G.; Fam, Y.; Sheppard, T.; Grunwaldt, J.-D.; Schroer, C. (2022, September 6). PTyNAMi: Ptychographic nano-analytical microscope. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Schulte, M.; Chacko, R.; Serrer, M.-A.; Stehle, M.; Angeli, S.; Gossler, H.; Shirsath, A.; Saraçi, E.; Deutschmann, O.; Grunwaldt, J.-D. (2022, June 28). Spatially-resolved insights into local activity and structure of Ni-based CO2 methanation catalysts in fixed-bed reactors. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Schulte, M. L.; Chacko, R.; Serrer, M.-A.; Stehle, M.; Angeli, S.; Gossler, H.; Shirsath, A. B.; Saraçi, E.; Deutschmann, O.; Grunwaldt, J.-D. (2022, January 10). Spatially-Resolved Insights into Local Activity and Structure of Ni Based CO2 Methanation Catalysts in Fixed-Bed Reactors. 758th WE-Heraeus Seminar (2022), Online, January 10–13, 2022.
Sharma, S.; Das, S.; Sanchez, D. F.; Marchuk, V.; Doronkin, D.; Delrieux, T.; Grunwaldt, J.-D.; Sheppard, T. (2022, September 5). Hard x-ray tomography for 3D spatially-resolved multiscale and multimodal characterization of non-model catalysts. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Stehle, M.; Klag, L.; Gaur, A.; Weber, S.; Sheppard, T.; Thomann, M.; Fischer, A.; Grunwaldt, J.-D. (2022, June 28). Multimodal operando insights into the activation of complex multicomponent catalysts during selective oxidation of propylene. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Struzek, S.; Delrieux, T.; Maurer, F.; Lott, P.; Tomin, S.; Casapu, M.; Koch, T.; Deutschmann, O.; Grunwaldt, J.-D. (2022, June 28). Spatially resolved characterization and conversion measurements on Pt/CeO2 based oxidation catalysts for emission control under realistic conditions. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Struzek, S.; Delrieux, T.; Zimina, A.; Goncalves, D. S.; Czechowsky, J.; Maurer, F.; Grunwaldt, J.-D. (2022, September 5). Characterization of industrial relevant catalytic materials for emission control using x-ray absorption spectroscopy. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Titus, J.; Abel, K. L.; Kuschel, O.; Weber, S.; Poppitz, D.; Sheppard, T.; Gläser, R. (2022, January 10). Control of Textural Properties and Ni Species of Ni-Catalysts Supported on Si-Stabilized ZrO₂. 758th WE-Heraeus Seminar (2022), Online, January 10–13, 2022.
Treu, P.; Huber, P.; Plessow, P.; Studt, F.; Saraçi, E. (2022, June 28). Bio-derived terephthalic acid precursors via the Diels-Alder reaction of isoprene and acrylate over solid Lewis acid Sn-BEA. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Warmuth, L.; Polierer, S.; Zevaco, T. A.; Pitter, S. (2022, June 27). Influence of impurities in H2 from different sources on the deactivation of methanol synthesis catalysts. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Germany, June 27–29, 2022.
Weber, S.; Abel, K. L.; Gläser, R.; Sheppard, T. L. (2022, January 10). X-ray Ptychography as a Tool to Understand Catalyst Synthesis and Deactivation in 3D. 758th WE-Heraeus Seminar (2022), Online, January 10–13, 2022.
Weber, S.; Schropp, A.; Lyubomirskiy, M.; Kahnt, M.; Jeromin, A.; Kulkarni, S.; Keller, T. F.; Sheppard, T. L. (2022, January 26). In situ Study of the Porosity Evolution of a Hierarchically Porous Catalyst by X-ray Ptychography. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2022), Online, January 21–28, 2022.
Wollak, B.; Sheppard, T.; Espinoza, D.; Doronkin, D.; Sturm, M.; Dippel, A.-C.; Gutowski, O.; Korup, O.; Schmidt, M.; Horn, R. (2022, September 5). Fixed-Bed Reactor for Operando Structure-Activity Profiling. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Zimina, A.; Goncalves, D. S.; Serrer, M.-A.; Pandit, L.; Eggart, D.; Grunwaldt, J.-D. (2022, September 6). Catalysis at the cat-act x-ray spectroscopy beamline at kit light source. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2022), Berlin, Germany, September 5–7, 2022.
Research Data
Dadvand, A.; Bagheri, M.; Samkhaniani, N.; Marschall, H.; Wörner, M. (2022, March 10). Research data for publication Dadvand et al. (2021) Physics-of-Fluids (doi: 10.1063/5.0048614). doi:10.5445/IR/1000134627
2021
Book Chapters
Dolcet, P.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D. (2021). Tracking the evolution of Pt single sites on CeO2. ESRF Highlights 2020, 123–125.
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
PhD Theses
Carriel Schmitt, C. (2021, January 7). Catalytic upgrading of fast pyrolysis bio-oils applying nickel-based catalysts. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000127623
Fec̆ík M. (2021, March 30). Theoretical studies of dehydration reactions and the aromatic cycle of the MTO process. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Smith, A. (2021, September 17). Theoretical Studies of Catalyst Structure and Kinetics in the MTO Process. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000137528
Stoll, I. K. (2021, October 8). Einfluss eines erhöhten Prozessdrucks bei der Fermentation von Synthesegas: Charakterisierung der Druckfermentation im Rührkesselreaktor. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Uzunidis, G. (2021). Synthese und Charakterisierung bimetallischer Nanopartikel in ionischen Flüssigkeiten für katalytische Anwendungen. PhD dissertation. Ruprecht-Karls-Universität Heidelberg.
Wodarz, S. (2021, February 2). Untersuchungen zum DTG-Prozess an pelletierten Zeolithkatalysatoren. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000128673
Journal Articles
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Delgado Otalvaro, N.; Sogne, G.; Herrera Delgado, K.; Wild, S.; Pitter, S.; Sauer, J. (2021). Kinetics of the direct DME synthesis from CO
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
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
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
Dolcet, P.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D. (2021). Insights into the Structural Dynamics of Pt/CeO
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
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
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
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
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
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
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
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
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
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
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
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
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
Goncalves, T. J.; Plessow, P. N.; Studt, F. (2021). Theoretical Study on the NO
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Paul, S.; Barman, D.; Chowdhury, C.; Giri, P. K.; De, S. K. (2021). 3D/2D Bi
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
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
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
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
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
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
Schmitt, S.; Schwarz, S.; Ruwe, L.; Horstmann, J.; Sabath, F.; Maier, L.; Deutschmann, O.; Kohse-Höinghaus, K. (2021). Homogeneous conversion of NO
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
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
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
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
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
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
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
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
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
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
Studt, F. (2021). Catalysis by unusual vacancies. Nature Catalysis, 4 (3), 184–185. doi:10.1038/s41929-021-00593-2
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
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
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
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
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
Warmuth, L.; Nails, G.; Casapu, M.; Wang, S.; Behrens, S.; Grunwaldt, J.-D.; Feldmann, C. (2021). Catalytic co oxidation and H
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
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
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
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
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
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
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
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
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
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
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
Conference Papers
Arnold, U.; Haltenort, P.; Drexler, M.; Sauer, J. (2021). Recent developments in the field of oxymethylene ethers (OMEs) as diesel fuels. 13th International Colloquium Fuels - Conventional and Future Energy for Automobiles : conference proceesings 2021 ; [Ostfildern, 15.-16.09.2021]. Ed.: Nikolai Schubert, 75–81, expert-Verlag.
Bertótiné Abai, A.; Zengel, D.; Janzer, C.; Maier, L.; Grunwaldt, J.-D.; Olzmann, M.; Deutschmann, O. (2021). Effect of NO₂ on Gas-Phase Reactions in Lean NOₓ/NH₃/O₂/H₂O Mixtures at Conditions Relevant for Exhaust Gas Aftertreatment. Automotive Technical Papers, SAE International. doi:10.4271/2021-01-5005
Drexler, M.; Haltenort, P.; Arnold, U.; Sauer, J.; Triantafyllidis. K. S. (2021). Progress in the anhydrous production of oxymethylene ether (OME) as a renewable diesel fuel in a liquid phase process. 5th EuChemS Conference on Green and Sustainable Chemistry, 26 - 29 September, 2021, Virtual Conference, Conference Proceedings, 60–61.
Fan, Y.; Hornung, U.; Dahmen, N. (2021). Challenges and strategies of hydrothermal liquefaction of sewage sludge. 29th European Biomass Conference and Exhibition, EUBCE 2021, 26th to 29th April 2021, Marseille & Online, 773–780.
Fuchs, C.; Betz, M.; Arnold, U.; Sauer, J. (2021). Production of sustainable fuels by heterogeneously catalyzed oligomerization of C2-C4 olefins. 13th International Colloquium Fuels - Conventional and Future Energy for Automobiles : conference proceesings 2021 ; [Ostfildern, 15.-16.09.2021]. Ed.: Nikolai Schubert, 83–91, expert-Verlag.
Göller, A.; Jungstand, B.; Dahmen, N.; Raffelt, K. (2021). Microwave spectroscopy for pyrolytic bio-slurries. 13th International Conference on Electromagnetic Wave Interaction with Water and Moist Substances (ISEMA), 1–6, Institute of Electrical and Electronics Engineers (IEEE). doi:10.1109/ISEMA49699.2021.9508275
Sauer, J.; Kolb, T.; Pfeifer, P.; Müller-Langer, F.; Klemm, M.; Jürgens, S.; Peters, R.; Hadrich, M. J.; Schaadt, A.; Harnisch, F.; Zuberbühler, U. (2021). Synthetische Kraftstoffe - Technologien, Prozessketten, Kohlenstoffquellen und Produkte. FVEE-Jahrestagung 2020, 43–47, ForschungsVerbund Erneuerbare Energien (FVEE).
Schmitt, C. C.; Moreira, R.; Raffelt, K.; Hoj, M.; Jensen, A. D.; Grunwaldt, J.-D.; Dahmen, N. (2021). Evaluation of nickel-based catalysts for hydrotreatment of bio-oil model compound mixtures in a continuous flow reactor: Selectivity and resistance to sulfur poisoning. European Biomass Conference and Exhibition Proceedings, 29th European Biomass Conference and Exhibition, EUBCE 2021, Virtual, Online, 26 April 2021 - 29 April 2021, 934–941, ETA-Florence Renewable Energies.
Reports/Preprints
Heinzmann, P.; Glöser-Chahoud, S.; Dahmen, N.; Langenmayr, U.; Schultmann, F. (2021). Techno-ökonomische Bewertung der Produktion regenerativer synthetischer Kraftstoffe. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000140638
Presentations
Bagheri, M.; Stumpf, B.; Roisman, I.; Wörner, M.; Marschall, H. (2021, January 14). Phase-Field Simulation of Drop Impact On a Liquid Film : The Critical Role of Interfacial Mixing Energy. 14th World Congress on Computational Mechanics (WWCM 2020) - 8th European Congress on Computational Methods in Applie Sciences (ECCOMAS 2020) (2021), Online, January 11–15, 2021.
Bagheri, M.; Stumpf, B.; Roisman, I. V.; Wörner, M.; Marschall, H. (2021, March 10). Computational analysis of crown formation during drop impact onto a liquid film with experimental validation. Jahrestreffen der ProcessNet Fachgruppen Mehrphasenströmung (MPH) und Computational Fluid Dynamics (CFD 2021), Paderborn, Germany, March 9–10, 2021.
Bagheri, M.; Wörner, M.; Marschall, H. (2021, June 11). Development and validation of a phase-field method for an arbitrary number of immiscible incompressible fluids. 16. OpenFOAM Workshop (OFW 2021), Online, June 8–11, 2021.
Dahmen, N.; Koch, T.; Rauch, R.; Sauer, J.; Toedter, O. (2021, January 18). Advanced fuels for the existing fleet – Results from the reFuels project. 18th International Conference on Renewable Mobility "Fuels of the Future" (2021), Online, January 18–22, 2021.
Drexler, M.; Arnold, U.; Haltenort, P.; Sauer, J. (2021). Advances in production and design of oxymethylene ether (OME) fuels. 9th International Conference Fuel Science - From Production to Propulsion (2021), Online, June 22–24, 2021.
Drexler, M.; Haltenort, P.; Arnold, U.; Sauer, J.; Triantafyllidis. K. S. (2021). Progress in the anhydrous production of oxymethylene ether (OME) as a renewable diesel fuel in a liquid phase process. 5th EuChemS Conference on Green and Sustainable Chemistry (2021), Online, September 26–29, 2021.
Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Wild, S.; Studt, F.; Pitter, S.; Sauer, J. (2021, May 11). Surface reaction kinetics of the methanol synthesis on Cu/Zn-based catalysts. Annual Meeting on Reaction Engineering (2021), Online, May 10–12, 2021.
Maurer, F.; Jelic, J.; Wang, J.; Gänzler, A.; Dolcet, P.; Wöll, C.; Wang, Y.; Studt, F.; Casapu, M.; Grunwaldt, J.-D. (2021, March 19). Tracking the structure of Pt single sites on CeO₂ and their CO, C₃H₆ and CH₄ oxidation activity. 54. Jahrestreffen Deutscher Katalytiker (2021), Online, March 16–19, 2021.
Neukum, D.; Schade, O.; Grunwaldt, J.-D.; Saraçi, E. (2021, November 18). Oxidative esterification of HMF with and without base to renewable monomers with supported gold catalysts. 6th Green and Sustainable Chemistry Conference (2021), Online, November 16–18, 2021.
Perret, L.; Dominke, X.; Stoll, I. K.; Boukis, N.; Sauer, J. (2021, May 19). Effizienzsteigerung der Synthesegasfermentation mit Clostridium ljungdahlii durch den Einsatz einer Zellrückhaltung in einem kontinuierlich betriebenen Rührkesselreaktor. ETG-Kongress (2021), Online, May 18–19, 2021.
Treu, P.; Huber, P.; Plessow, P. N.; Saraçi, E. (2021, November 16). Bio-derived terephthalic acid precursors via the Diels-Alder reaction of isoprene and acrylate over solid Lewis acid Sn-BEA. 6th Green and Sustainable Chemistry Conference (2021), Online, November 16–18, 2021.
Weber, S.; Abel, K. L.; Gläser, R.; Sheppard, T. L. (2021). Unravelling the Pore Structure of a Ni/Al₂O₃ Catalyst by Tomography. 23rd JCF Frühjahrssymposium (2021), Online, March 29–April 1, 2021.
Weber, S.; Batey, D.; Cipiccia, S.; Sheppard, T. L. (2021, August 29). X-ray Nanotomography Reveals Coking of Nickel-based Catalysts Spatially-Resolved in 3D. GDCh-Wissenschaftsforum Chemie : Chemists create solutions (WiFo 2021), Online, August 29–September 1, 2021.
Weber, S.; Diaz, A.; Holler, M.; Schropp, A.; Lyubomirskiy, M.; Abel, K. L.; Kulkarni, S.; Keller, T.; Gläser, R.; Sheppard, T. L. (2021, August 13). Following Calcination and Porosity Evolution with Nanometer Resolution by Ptychographic X-ray Microscopy. 104th IUPAC CCCE 2021 - 104th Canadian Chemistry Conference and Exhibition : Solving Global Challenges with Chemistry (IUPAC | CCCE 2021), Online, August 13–20, 2021.
Weber, S.; Sheppard, T. L. (2021, January). Demanding Sample Environment and Preparation for in situ Ptychographic X-ray Microscopy Studies of Nickel-based Methanation Catalysts. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2021), Online, January 25–29, 2021.
Posters
Drexler, M.; Arnold, U.; Haltenort, P.; Sauer, J. (2021). Zeolite-catalyzed production of OME in an anhydrous liquid phase process. Annual Meeting on Reaction Engineering (2021), Online, May 10–12, 2021.
Eggart, D.; Huang, X.; Zimina, A.; Pan, X.; Grunwaldt, J.-D. (2021, March 17). Platinum doped ceria catalysts for direct conversion of methane. 54. Jahrestreffen Deutscher Katalytiker (2021), Online, March 16–19, 2021.
Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Wild, S.; Studt, F.; Pitter, S.; Sauer, J. (2021, March 17). Microkinetic modeling of the methanol synthesis on Cu/Zn-based catalysts. 54. Jahrestreffen Deutscher Katalytiker (2021), Online, March 16–19, 2021.
Perret, L.; Dominke, X.; Stoll, I. K.; Boukis, N.; Sauer, J. (2021, April). Efficiency enhancement of synthesis gas fermentation with Clostridium ljungdahlii by the use of cell retention in a contin-uously operated stirred tank reactor (CSTR). 29th European Biomass Conference and Exhibition (EUBCE 2021), Online, April 20–29, 2021.
Samkhaniani, N.; Stroh, A.; Marschall, H.; Frohnapfel, B.; Wörner, M. (2021, March 10). Drop impingement on heated hydrophobic surfaces. Jahrestreffen der ProcessNet-Fachgruppen "Abfallbehandlung und Wertstoffrückgewinnung, Energieverfahrenstechnik, Gasreinigung, Hochtemperaturtechnik, Rohstoffe" (2017), Frankfurt am Main, Germany, March 21–23, 2017.
Saraci, E.; Schade, O.; Stein, F.; Reichenberger, S.; Gaur, A.; Barcikowski, S.; Grunwaldt, J.-D. (2021, March). Selective Aerobic Oxidation of 5-(Hydroxymethyl)furfural over Silver-Gold Alloyed Nanoparticle Catalysts. 54. Jahrestreffen Deutscher Katalytiker (2021), Online, March 16–19, 2021.
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. (2021, March). Porosity and Structural Analysis of a Hierarchical Porous Ni/Al₂O₃ Catalyst for CO₂ Methanation. 54. Jahrestreffen Deutscher Katalytiker (2021), Online, March 16–19, 2021.
Weber, S.; Schunk, S. (2021, March 19). Novel Plasma Synthesis of Mayenite-based Electrides and their Catalytic Application for Ammonia Synthesis. 54. Jahrestreffen Deutscher Katalytiker (2021), Online, March 16–19, 2021.
Weber, S.; Sheppard, T. L. (2021, February). Porosity Analysis of Ni/Al₂O₃ Catalysts by Multi-scale Tomography. 5th Annual Workshop on Advances in X-ray Imaging (2021), Online, February 1–2, 2021.
Research Data
Weber, S.; Sheppard, T. (2021, November 29). Reconstructed ptychographic X-ray computed tomography data sets of the dried gel Ni/Al
Weber, S.; Sheppard, T.; Huang, X.; Kübel, C. (2021, December 15). Electron Tomography Datasets of a Ni/Al
Weber, S.; Sheppard, T. (2021, December 15). Holographic X-ray computed tomography datasets of an activated Ni/Al
Weber, S.; Sheppard, T. L. (2021, May 12). Reconstructed ptychographic X-ray computed tomography data of an artificially coked hierarchical porous Ni/Al
Weber, S.; Sheppard, T. L. (2021, May 12). Reconstructed ptychographic X-ray computed tomography data of an activated hierarchical porous Ni/Al
Weber, S.; Sheppard, T. L. (2021, May 12). Reconstructed ptychographic X-ray computed tomography data of an artificially coked mesoporous Ni/Al
Weber, S.; Sheppard, T. L. (2021, May 12). Reconstructed ptychographic X-ray computed tomography data of an activated mesoporous Ni/Al
Audio & Video
2020
PhD Theses
Dietze, E. M. (2020). Theoretical investigation of catalyst stability and deactivation. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000104570
Erdogan, S. (2020, October 7). Numerical Analysis and Modelling of Liquid Turbulence in Bubble Columns at Various Scales by Computational Fluid Dynamics. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000124150
Fan, Y. (2020, November 9). The fate of nitrogen during hydrothermal liquefaction of sewage sludge. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000125800
Ferreira Gonçalves, T. J. (2020, May 19). Theoretical Studies of OME-synthesis and Ammonia SCR in Zeolite Catalysis. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000119501
Guo, B. (2020). Hydrothermal liquefaction within a microalgae biorefinery. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000105190
Schuler, J. (2020, March 2). Hydrothermal liquefaction of lignin. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000117444
Steinbach, D. (2020, October 28). Umsetzung von Lignocellulosen zu Hydroxymethylfurfural in einer hydrothermalen Bioraffinerie. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000125267
Master's Theses
Gandert, J. (2020). Model Set Up for the Stabilization of PAN Fibers - Implementation of the Reaction Kinetics and Analysis of Heat Input and Heat Transfer. master’s thesis. Karlsruher Institut für Technologie (KIT).
Journal Articles
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Giehr, A.; Maier, L.; Angeli, S.; Schunk, S. A.; Deutschmann, O. (2020). Dry and Steam Reforming of CH
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
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
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
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
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
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
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
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
Karadeniz, H.; Karakaya, C.; Tischer, S.; Deutschmann, O. (2020). Numerical Simulation of Methane and Propane Reforming Over a Porous Rh/Al
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Perilli, D.; Di Valentin, C.; Studt, F. (2020). Can Single Metal Atoms Trapped in Defective h-BN/Cu(111) Improve Electrocatalysis of the H
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
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
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
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
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
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
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
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
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
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
Schäfer, B.; Sauer, J. (2020). Trends der chemischen Prozessindustrie. Chemie - Ingenieur - Technik, 92 (3), 183–191. doi:10.1002/cite.201900178
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Yu, J.; Yang, M.; Zhang, J.; Ge, Q.; Zimina, A.; Pruessmann, T.; Zheng, L.; Grunwaldt, J.-D.; Sun, J. (2020). Stabilizing Cu
Zakutanská, K.; Feoktystov, A.; Lacková, V.; Tomašovičová, N.; Appel, I.; Behrens, S.; Kopčanský, P. (2020). SANS Study of Liquid Crystal Doped with CoFe
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
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
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
Zimmermann, R.; Siebert, M.; Ibrahimkutty, S.; Dittmeyer, R.; Armbrüster, M. (2020). Intermetallic GaPd
Conference Papers
Arnold, U.; Drexler, M.; Haltenort, P.; Sauer, J. (2020). Catalytic (trans)acetalization reactions for the production of oxymethylene ether (OME) fuels. Fuel Science - From Production to Propulsion : 8th International Conference, June 23 to 25, 2020, Online ; Book of Abstracts ; #fuelscience2020, 53–55, The Fuel Science Center (FSC).
Drexler, M.; Arnold, U.; Haltenort, P.; Sauer, J. (2020). Oxymethylene ethers (OMEs) as diesel fuels: State of the art and perspectives. DGMK-Conference The Future of Chemicals and Fuels – Feedstocks and Process Technologies, October 7-9, 2020, Web Conference, Deutsche Wissenschaftliche Gesellschaft für Erdöl, Erdgas und Kohle e.V. (DGMK).
Drexler, M.; Arnold, U.; Haltenort, P.; Sauer, J. (2020). Production of oxymethylene ether as renewable liquid fuel in an anhydrous process. 3rd Doctoral Colloquium Bioenergy : Leipzig, September 17-18, 2020, Web Conference, Book of Abstracts, 126–127, Deutsches Biomasseforschungszentrum (DBFZ).
Guo, B.; Frey, W.; Hornung, U.; Dahmen, N. (2020). Biorefinery of Microalgae via Combination of Pulsed Electric Field Treatment and Hydrothermal Liquefaction - A Techno-Economic Assessment. 28th European Biomass Conference and Exhibition Proceedings, EUBCE 2020, 526–529, ETA-Florence Renewable Energies. doi:10.5071/28thEUBCE2020-3BO.3.4
Toedter, O.; Dahmen, N.; Wagner, U.; Scheer, D.; Koch, T.; Sauer, J. (2020). reFuels - rethinking Fuels for CO2 neutral mobility. SIA 2020 digital Powertain & Energy.
Reports/Preprints
Murphy, B. M.; Grunwaldt, J.-D.; Griewatsch, K. (2020). Forschung mit Photonen - Licht für die Zukunft: Komitee Forschung mit Synchrotronstrahlung. Zenodo. doi:10.5281/zenodo.13629361
Murphy, B. M.; Grunwaldt, J.-D.; Griewatsch, K. (2020). Research with Photons - Light for the Future, German Committee for Research with Synchrotron Radiation. Zenodo. doi:10.5281/zenodo.13377850
Presentations
Arnold, U.; Drexler, M.; Haltenort, P.; Sauer, J. (2020). Catalytic (trans)acetalization reactions for the production of oxymethylene ether (OME) fuels. 8th International Conference Fuel Science - From Production to Propulsion (2020), Online, June 23–25, 2020.
Doronkin, D. E. (2020, January 30). QEXAFS-XRD combination at P64, and the high temperature setup at P65. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2020), Hamburg, Germany, January 30–31, 2020.
Bähr, J.; Raffelt, K. (2020, September 28). FT2.3 Verlinkung entlang der Prozesskette "Thermochemische Biomasse-Konversion". (M. Eberhard, Ed.), Abschlusskonferenz Energie System 2050 (2020), Berlin, Germany, September 28–29, 2020.
Kornatz, P.; Daniel-Gromke, J.; Thrän, D.; Krautkremer, B.; Mercker, O.; Laub, K.; Matschoss, P.; Musonda, F.; Dahmen, N.; Rösch, C.; Musonda, F. (2020). Bioenergie als intelligenter Baustein für ein nachhaltiges europäisches Energiesystem. FVEE-Jahrestagung (2020), Online, November 2–4, 2020.
Marschall, H.; Bagheri, M.; Samkhaniani, N.; Stroh, A.; Frohnapfel, B.; Wörner, M. (2020, October 12). Simulation of droplet impact at high dynamics using a diffuse interface phase-field methods in OpenFOAM. International Conference on Advances in Differential Equations and Numerical Analysis (ADENA 2020), Online, October 12–15, 2020.
Marschall, H.; Bagheri, M.; Samkhaniani, N.; Stroh, A.; Frohnapfel, B.; Wörner, M. (2020, June 25). Development and Deployment of Diffuse Interface Phase-Field Methods In Openfoam. 15th OpenFOAM Workshop (OFW 2020), Online, June 22–25, 2020.
Samkhaniani, N.; Marschall, H.; Frohnapfel, B.; Wörner, M. (2020, March 11). Reproducing the rich physics of drop impingement experiments on hydrophobic surfaces by phase field simulations. Jahrestreffen der ProcessNet-Fachgruppen Computational Fluid Dynamics und Gasreinigung (2020), Bamberg, Germany, March 10–11, 2020.
Sheppard, T. L. (2020, January 30). Sample cells for X-ray ptychography and nanotomography - towards operando chemical imaging of catalysts andfunctional materials. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2020), Hamburg, Germany, January 30–31, 2020.
Straczewski, G.; Garbev, K.; Leibold, H.; Vargas, C.; Zampieri, A.; Dahmen, N. (2020, March 10). Totaloxidation von Kohlenmonoxid und VOCs mit katalytischen Keramik-Filterkerzen. Jahrestreffen der ProcessNet-Fachgruppen Computational Fluid Dynamics und Gasreinigung (2020), Bamberg, Germany, March 10–11, 2020.
Wörner, M. (2020, March 11). Tropfendynamik in Wandnähe - Möglichkeiten und Limitierungen von grenzflächenauflösenden Simulationen = Drop dynamics near walls − achievements and limitations of interface-resolving simulations. Jahrestreffen der ProcessNet-Fachgruppen Computational Fluid Dynamics und Gasreinigung (2020), Bamberg, Germany, March 10–11, 2020.
Posters
Bagheri, M.; Marschall, H.; Wörner, M. (2020, March 9). Interface-resolving simulation of droplet impact on liquid film of the same fluids using the phase-field method. 715. WE-Heraeus Seminar (2020), Bad Honnef, Germany, March 8–12, 2020.
Doronkin, D. E.; Marchuk, V.; Casapu, M.; Grunwaldt, J.-D. (2020, January 30). Operando XAS study of Pt catalysts for selective oxidation of ammonia. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2020), Hamburg, Germany, January 30–31, 2020.
Doronkin, D. E.; Zimina, A.; Serrer, M.-A.; Pruessmann, T.; Grunwaldt, J.-D. (2020, January 29). Operando X-ray Absorption Spectroscopy (XAS) under industrially relevant conditions at the CAT-ACT beamline. GeCatS Infoday "Operando Spectroscopy in Catalysis – Time to Implement this Methodology in Industry" (2020), Frankfurt am Main, Germany, January 29, 2020.
Drexler, M.; Arnold, U.; Haltenort, P.; Sauer, J. (2020). Oxymethylene ethers (OMEs) as diesel fuels: State of the art and perspectives. DGMK-Conference The Future of Chemicals and Fuels – Feedstocks and Process Technologies (2020), Online, October 8, 2020.
Drexler, M.; Arnold, U.; Haltenort, P.; Sauer, J. (2020). Production of oxymethylene ether as renewable liquid fuel in an anhydrous process. 3rd Doctoral Colloquium BIOENERGY (DOC2021 2020), Online, September 14–18, 2020.
Marchuk, V.; Doronkin, D.; Grunwaldt, J.-D. (2020, January 28). Operando QEXAFS study of ammonia slip catalysts during realistic driving cycles. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2021), Online, January 25–29, 2021.
Wörner, M. (2020, September 24). Hydrodynamische Charakterisierung der Taylorströmung in kreisförmigen Kapillaren auf Basis vorab bekannter Parameter. 10./34. ProcessNet-Jahrestagung und DECHEMA-Jahrestagung der Biotechnologen (2020), Online, September 21–24, 2020.
Zimina, A.; Pruessmann, T.; Doronkin, D. E.; Grunwaldt, J.-D. (2020, January 29). CAT-ACT - A highly versatile X-ray spectroscopy beamline for catalysis science at KIT. GeCatS Infoday "Operando Spectroscopy in Catalysis – Time to Implement this Methodology in Industry" (2020), Frankfurt am Main, Germany, January 29, 2020.
Research Data
Becher, J.; Ferreira Sanchez, D.; Doronkin, D.; Zengel, D.; Motta Meira, D.; Pascarelli, S.; Grunwaldt, J.-D.; Sheppard, T. (2020, October 20). Full-Field XANES tomography data of a Cu-SSZ-13 washcoated monolith: NO + O2 @ 200°C dataset. doi:10.5445/IR/1000122895
Becher, J.; Ferreira Sanchez, D.; Doronkin, D.; Zengel, D.; Motta Meira, D.; Pascarelli, S.; Grunwaldt, J.-D.; Sheppard, T. (2020, October 20). Full-Field XANES tomography data of a Cu-SSZ-13 washcoated monolith: NH3 @ 200°C dataset. doi:10.5445/IR/1000122894
Becher, J.; Ferreira Sanchez, D.; Doronkin, D.; Zengel, D.; Motta Meira, D.; Pascarelli, S.; Grunwaldt, J.-D.; Sheppard, T. (2020, October 20). Full-Field XANES tomography data of a Cu-SSZ-13 washcoated monolith: SCR @ 400°C dataset. doi:10.5445/IR/1000122893
Becher, J.; Ferreira Sanchez, D.; Doronkin, D.; Zengel, D.; Motta Meira, D.; Pascarelli, S.; Grunwaldt, J.-D.; Sheppard, T. (2020, October 20). Full-Field XANES tomography data of a Cu-SSZ-13 washcoated monolith: SCR @ 350°C dataset. doi:10.5445/IR/1000122892
Becher, J.; Ferreira Sanchez, D.; Doronkin, D.; Zengel, D.; Motta Meira, D.; Pascarelli, S.; Grunwaldt, J.-D.; Sheppard, T. (2020, October 20). Full-Field XANES tomography data of a Cu-SSZ-13 washcoated monolith: SCR @ 200°C dataset. doi:10.5445/IR/1000122874
Becher, J.; Ferreira Sanchez, D.; Doronkin, D.; Zengel, D.; Motta Meira, D. P., Sakura; Grunwaldt, J.-D.; Sheppard, T. (2020, October 20). Full-Field XANES tomography data of a Cu-SSZ-13 washcoated monolith: SCR @ 300°C dataset. doi:10.5445/IR/1000122890
Audio & Video
Wetzel, C.; Wiebe, S.; Haas-Santo, K. (2020). FAQ reFuels: Was sind die Herausforderungen bei der Herstellung von reFuels-Diesel?. doi:10.5445/IR/1000127720
Wetzel, C.; Wiebe, S.; Langenmayr, U. (2020). FAQ reFuels: Gibt es den Überschussstrom wirklich?. doi:10.5445/IR/1000127721
Wetzel, C.; Wiebe, S.; Scheer, D. (2020). FAQ reFuels: Wie helfen reFuels bei der Erfüllung von Klimaschutzzielen?. doi:10.5445/IR/1000122862
Wetzel, C.; Wiebe, S.; Wagner, U. (2020). FAQ reFuels: Sollen reFuels den Verbrennungsmotor retten?. doi:10.5445/IR/1000118682
Wiebe, S.; Wetzel, C.; Andresh, M. (2020). FAQ reFuels: Wie nachhaltig ist die gesamte Prozesskette?. doi:10.5445/IR/1000118410
Wiebe, S.; Wetzel, C.; Arnold, U. (2020). FAQ reFuels: Was sind die Herausforderungen bei der Herstellung von reFuels-Ottokraftstoff?. doi:10.5445/IR/1000118740
Wiebe, S.; Wetzel, C.; Dahmen, N. (2020). FAQ reFuels: Wie werden reFuels hergestellt?. doi:10.5445/IR/1000118753
Wiebe, S.; Wetzel, C.; Koch, T. (2020). FAQ reFuels: Wer ist am reFuels-Projekt beteiligt?. doi:10.5445/IR/1000118742
Wiebe, S.; Wetzel, C.; Toedter, O. (2020). FAQ reFuels: Müssen reFuels noch weiterentwickelt werden?. doi:10.5445/IR/1000118747
Wiebe, S.; Wetzel, C.; Weyhing, T. (2020). FAQ reFuels: Wirken sich reFuels schädlich auf das Fahrzeug aus?. doi:10.5445/IR/1000118707
Wiebe, S.; Wetzel, C.; Zabihigivi, M. (2020). FAQ reFuels: Sind reFuels auch besser für die Umwelt?. doi:10.5445/IR/1000118757
Images
Thomas Zevaco, D. R., Axel Funke. (2020). Efilter of the fast pyrolysis plant "Python" after several hours of operation. doi:10.5445/IR/1000120168
,Zevaco, Thomas. (2020). Direct Thermochemical Liquefaction of Biomass to Renewable Fuels. doi:10.5445/IR/1000120883
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
PhD Theses
Elsayed, S. (2019). Gasification of algal biomass in supercritical water with the potential of energy and nutrients recovery. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000099951
Rohde, V. (2019). Optimierung eines säure-katalysierten Ethanol-Wasser Organosolv-Prozesses für die Biomassen Pappel mit Rinde und Miscanthus G. in Hinblick auf Ligninfraktionierung und -funktionaliserung. PhD dissertation. Fraunhofer Verlag.
Master's Theses
Hagg, D. (2019, June 28). Direkte numerische Simulation von transientem Benetzungsverhalten in komplexen Dichtspaltgeometrien unter Verwendung von phaseFieldFoam. master’s thesis. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000145948
Wang, S. (2019, January 31). Numerical Simulation of the Cutting of a Rising Bubble by a Horizontal Cylinder = Numerische Simulation von Zerteilung einer steigenden Blase durch einen Horizontalen Zylinder. master’s thesis. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000135974
Journal Articles
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
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
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
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
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
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
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
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
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
Dan, M.; Wei, S.; Doronkin, D. E.; Li, Y.; Zhao, Z.; Yu, S.; Grunwaldt, J.-D.; Lin, Y.; Zhou, Y. (2019). Novel MnS/(In
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Koch, T.; Sauer, J.; Toedter, O.; Hirth, T. (2019). reFuels - Notwendigkeit und Herausforderungen. Automobiltechnische Zeitschrift, 24 (S 2), 28–31.
Kulsha, A. V.; Sharapa, D. I. (2019). Superhalogen and Superacid. Journal of computational chemistry, 40 (26), 2293–2300. doi:10.1002/jcc.26007
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
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
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
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
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
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
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
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
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
Sauer, J.; Klemm, E. (2019). Beitrag der chemischen Reaktionstechnik zur Energiewende. Chemie - Ingenieur - Technik, 91 (5), 543. doi:10.1002/cite.201970052
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Conference Papers
Arnold, U.; Betz, M.; Hackbarth, K.; Haltenort, P.; Klein, G.; Niethammer, B.; Sauer, J. (2019). From renewable resources to fuels - the role of alcohols. Fuels : conventional and future energy for automobiles. Hrsg. N. Schubert, 167–177, Technische Akademie Esslingen (TAE).
Dahmen, N.; Zimmerlin, B.; Eberhard, M.; Lam, H.; Mai, R.; Michelfelder, B.; Niebel, A.; Otto, T.; Pfitzer, C.; Weih, N.; Willy, M.; Leibold, H.; Kolb, T.; Sauer, J.; Stapf, D. (2019). Bioliq®-pilot plant for the preparation of synthetic fuels-operating experience. 27th European Biomass Conference and Exhibition, EUBCE 2019; Lisbon; Portugal; 27 May 2019 through 30 May 2019. Ed.: N. Scarlat, 565–569, ETA-Florence Renewable Energies.
Fonseca, F. G.; Funke, A.; Dahmen, N. (2019). Aspen plus™ modeling of fractional condensation schemes for production of fast pyrolysis bio-oil. 27th European Biomass Conference and Exhibition, EUBCE 2019; Lisbon; Portugal; 27 May 2019 through 30 May 2019, 1227–1233, ETA-Florence Renewable Energies. doi:10.5071/27thEUBCE2019-3BV.7.9
Fonseca, F. G.; Funke, A.; Saechua, W.; Sirisomboon, P. (2019). Precision test for the spectral characteristic of FT-NIR for the measurement of water content of wheat straw. 12th Thai Society of Agricultural Engineering International Conference, TSAE 2019: Pattaya, Thailand, 14-15 March 2019, Art.-Nr.: 012034, Institute of Physics Publishing Ltd (IOP Publishing Ltd). doi:10.1088/1755-1315/301/1/012034
Guo, B.; Yang, B.; Silve, A.; Akaberi, S.; Scherer, D.; Papachristou, I.; Frey, W.; Hornung, U.; Dahmen, N. (2019). Hydrothermal liquefaction of valuables-extracted microalgae with help of pulsed electric field treatment. Proceedings of the 27th European Biomass Conference and Exhibition, 1127–1131, ETA-Florence Renewable Energies. doi:10.5071/27thEUBCE2019-3AV.4.3
Hennig, C.; Majer, S.; Oehmichen, K.; Hirschl, B.; Heinbach, K.; Dahmen, N.; Rau, I.; Hildebrand, J.; Schweizer-Ries, P.; Erlach, B.; Thrän, D. (2019). Assessment framework for integrated bioenergy strategies. 27th European Biomass Conference and Exhibition, EUBCE 2019; Lisbon; Portugal; 27 May 2019 through 30 May 2019, 1779–1780, ETA-Florence Renewable Energies.
Niethammer, B.; Arnold, U.; Sauer, J. (2019). Modified catalysts for a low-aromatic Dimethyl ether-To-Gasoline process. Bridging Science with Technology : A Renaissance in Chemical Engineering., 1068–1069, AIDIC Servizi.
Rosendahl, L. A.; Cocchi, M.; Iversen, S.; Heracleous, E.; Dallo, I. L.; Lercher, J.; Raffelt, K.; Sandquist, J.; Verdier, S.; Bianchi, D.; Hellings, B.; Grassi, A.; Momi, S. (2019). Sustainable drop-in transport fuels from hydrothermal liquefaction of low value urban feedstocks-nextgenroadfuels project. 27th European Biomass Conference and Exhibition, EUBCE 2019; Lisbon; Portugal; 27 May 2019 through 30 May 2019, 1166–1168, ETA-Florence Renewable Energies.
Stoll, I. K.; Boukis, N.; Sauer, J. (2019). Syngas fermentation at elevated pressure – experimental results. 27th European Biomass Conference and Exhibition, EUBCE 2019; Lisbon; Portugal; 27 May 2019 through 30 May 2019, 1255–1261, ETA-Florence Renewable Energies.
Stoll, I. K.; Boukis, N.; Sauer, J. (2019). Syngas fermentation at elevated pressure - experimental results. Proceedings of the 27th European Biomass Conference and Exhibition, 1255–1261. doi:10.5071/27thEUBCE2019-3CV.3.4
Toedter, O.; Wagner, U.; Koch, T.; Dahmen, N.; Pitter, S.; Sauer, J.; Scheer, D. (2019). Sector coupling established by the technology partnership reFuels - rethinking fuels. 12. International Colloquium Fuels, Esslingen, 25 - 26 Juni 2019, 5–10, Technische Akademie Esslingen (TAE).
Yu, S.; Fritz, B.; Theobald, D.; Wu, K.; Johnsen, S.; Busko, D.; Richards, B. S.; Wiegand, G.; Tang, Y.; Li, Z.; Lemmer, U.; Holscher, H.; Gomard, G. (2019). Enhanced color conversion of quantum dots - polymer hybrid films in light emitting diodes. 20th International Conference on Electronic Packaging Technology (ICEPT 2019), 1–4, Institute of Electrical and Electronics Engineers (IEEE). doi:10.1109/ICEPT47577.2019.245231
Zimmerlin, B.; Eberhard, M.; Lam, H.; Mai, R.; Michelfelder, B.; Niebel, A.; Otto, T.; Pfitzer, C.; Weih, N.; Willy, M.; Leibold, H.; Dahmen, N.; Kolb, T.; Sauer, J.; Stapf, D. (2019). bioliq®-Pilotanlage zur Herstellung synthetischer Kraftstoffe - Betriebserfahrungen [Proceedingsbeitrag]. DGMK-Fachbereichstagung: Thermochemische Konversion – Schlüsselbaustein für zukünftige Energie- und Rohstoffsysteme, Dresden, 23.-24. Mai 2019.
Presentations
Arnold, U.; Betz, M.; Hackbarth, K.; Haltenort, P.; Klein, G.; Niethammer, B.; Sauer, J. (2019). From renewable resources to fuels - the role of alcohols. 12th International Colloquium Fuels - Conventional and Future Energy for Automobiles (2019), Ostfildern, Germany, June 25–26, 2019.
Becher, J.; Sheppard, T.; Meira, D. M.; Sanchez, D. F.; Doronkin, D.; Pascarelli, S.; Grunwaldt, J.-D. (2019, August). 3D spectrotomography of a structured honeycomb Cu-SSZ-13 exhaust gas catalyst under operando conditions. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Cai, X.; Samkhaniani, N.; Wörner, M.; Frohnapfel, B. (2019, May 10). Numerische Simulation von Tropfenaufprall und Filmbildung an der Wand. 7. Boysen Doktoranden-Treffen (2019), Altensteig, Germany, May 8–10, 2019.
Dietze, E. M.; Plessow, P. N. (2019). Modelling Ostwald ripening beyond mean-field models. DPG-Frühjahrstagung der Sektion Kondensierte Materie (SKM), Fachverband Oberflächenphysik (2019), Regensburg, Germany, March 31–April 5, 2019.
Dolcet, P.; Tofighi, G.; Schade, O.; Lott, P.; Grunwaldt, J.-D. (2019, August). Controlled synthesis of mono- and bimetallic nanoparticles via a microfluidic approach. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Doronkin, D.; Wang, S.; Deschner, B.; Sharapa, D.; Sheppard, T.; Zimina, A.; Dittmeyer, R.; Studt, F.; Behrens, S.; Grunwaldt, J.-D. (2019, August). Structure – Activity Relationships of Pd, PdSn, and PdIn Nanoparticles during Continuous Direct H2O2 Synthesis at High Pressure. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Doronkin, D. E.; Deschner, B. J.; Sheppard, T. L.; Selinsek, M.; Dittmeyer, R.; Grunwaldt, J.-D. (2019, January). Operando XAS at high pressure: observing Pd nanoparticles catalyzing direct synthesis of hydrogen peroxide. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2019), Hamburg, Germany, January 24–25, 2019.
Fan, Y.; Hornung, U.; Dahmen, N.; Kruse, A. (2019). The influence of lipids on the fate of nitrogen during hydrothermal liquefaction of protein-containing biomass. Pyroliq : Pyrolysis and Liquefaction of Biomass and Wastes (2019), Cork, Ireland, June 16–20, 2019.
Grunwaldt, J.-D. (2019, March). Tracking the active center in single site and supported metal catalysts. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Hornung, U. (2019, September 25). Erhält die HTL von Mikroalgen durch die Elektroporation neue Impulse?. HTP-Fachforum Hydrothermale Prozesse zur stofflichen und energetischen Wertschöpfung (2019), Leipzig, Germany, September 25–26, 2019.
Lott, P.; Eck, M.; Doronkin, D.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2019). Exhaust Gas after Treatment of Natural Gas Engines: A Systematic Operando Study on Sulfur Poisoning and Regeneration of Pd-Pt Methane Oxidation Catalysts. 26th North American Meeting of the Catalysis Society (NAM 26 2019), Chicago, IL, USA, June 23–28, 2019.
Lott, P.; Gremminger, A.; Boubnov, A.; Doronkin, D.; Eck, M.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2019, March). Regeneration strategies for methane oxidation catalysts. 4th North American Symposium on Chemical Reaction Engineering (NASCRE 2019), Houston, TX, USA, March 10–13, 2019.
Marschall, H.; Cai, X.; Wörner, M.; Deutschmann, O. (2019). A phase-field method for numerical simulation of interfacial two-phase flows using OpenFOAM. 6th GAMM Workshop on Phase-Field Modeling (2019), Karlsruhe, Germany, February 7–8, 2019.
Polierer, S.; Pitter, S.; Grunwaldt, J.-D.; Guse, D.; Delgado, K. H.; Jelic, J.; Kind, M.; Otto, T.; Stehle, M.; Studt, F.; Wild, S.; Zevaco, T.; Zimmermann, M. (2019, August). Copper-based methanol catalysts applied in the direct dimethyl ether synthesis from CO₂-rich syngas. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Polierer, S.; Wild, S.; Herrera Delgado, K.; Grunwaldt, J.-D.; Kind, M.; Pitter, S. (2019, June 25). CO₂-rich syngas, an option for energy-related chemical processes?. 17th International Conference on Carbon Dioxide Utilization (ICCDU 2019), Aachen, Germany, June 23–27, 2019.
Raun, K. V.; Thorhauge, M.; Gaur, A.; Grunwaldt, J.-D.; Jensen, J.; Høj, M. (2019, August). Experimental Investigations and Modelling of the Molybdenum Loss from Iron Molybdate Methanol Selective Oxidation Catalysts. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Schade, O.; Kalz, K.; Neukum, D.; Saraci, E.; Kleist, W.; Grunwaldt, J.-D. (2019, August). Controlling Selectivity: Selective oxidation of 5-(hydroxymethyl)furfural over gold- and silver-based catalysts. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Schwarz, S.; Yuan, W. H.; Ruwe, L.; Gossler, H.; Maier, L.; Qi, F.; Kohse-Höinghaus, K.; Deutschmann, O. (2019). Homogenous gas-phase reactions in exhaust aftertreatment systems of internal combustion engines. 29. Deutscher Flammentag (2019), Bochum, Germany, September 17–18, 2019.
Serrer, M.-A.; Kalz, K. F.; Saraci, E.; Lichtenberg, H.; Grunwaldt, J.-D. (2019, June). The Role of Iron for the Enhanced Stability of a Ni3Fe/Al2O3 Catalyst during Dynamic CO2 Methanation. 26th North American Meeting of the Catalysis Society (NAM 26 2019), Chicago, IL, USA, June 23–28, 2019.
Sheppard, T.; Fam, Y.; Schropp, A.; Schroer, C.; Grunwaldt, J.-D.; Gescher, J. (2019, August). Ptychographic X-ray computed tomography: a rapidly-emerging method for quantitative multiscale 3D chemical imaging in catalysis. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Sheppard, T.; Fam, Y.; Becher, J.; Diaz, A.; Holler, M.; Wittstock, A.; Falkenberg, G.; Schropp, A.; Schroer, C.; Grunwaldt, J.-D. (2019, March). Understanding Catalyst Complexity at Synchrotron Light Sources Using Hard X-ray Ptychography and Tomography. 148th TMS Annual Meeting and Exhibition, Symposium on Corrosion in Heavy Liquid Metals for Energy Systems (TMS 2019), San Antonio, TX, USA, March 10–14, 2019.
Sheppard, T. L. (2019). Harnessing X-ray (Spectro)microscopy for Chemical Imaging of Heterogeneous Catalysts. Annual Meeting of the Italian Synchrotron Radiation Society (SILS 2019), Camerino, Italy, September 9–11, 2019.
Sheppard, T. L. (2019). In situ and operando hard X-ray tomography from micro- to nanoscale: opportunities and applications in catalysis and materials science. Hands on ! High-pressure techniques at the ESRF-EBS (2019), Grenoble, France, June 17–21, 2019.
Sheppard, T. L. (2019). In situ ptychography in 2D and 3D for Catalysis and Materials Research. ESRF User Meeting 2019 - Microsymposia: Exploiting coherent X-rays at ESRF: robust tools for imaging and dynamics (2019), Grenoble, France, February 4–6, 2019.
Sprenger, P.; Stehle, M.; Kleist, W.; Grunwaldt, J.-D. (2019, August). Probing the reactivity of bismuth molybdates in selective propylene oxidation by correlative operando methods. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Walter, K.; Saraci, E.; Serrer, M.; Kleist, W.; Grunwaldt, J.-D. (2019, August). Continuous production of higher alcohols from synthesis gas and ethanol using Cs-modified CuO/ZnO/Al₂O₃ catalysts. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Wang, S.; Rohlfs, P.; Börnhorst, M.; Schillaci, A.; Marschall, H.; Deutschmann, O.; Wörner, M. (2019). Validierung einer Phasenfeldmethode für die Zerteilung einer aufsteigenden Blase durch einen horizontalen Zylinder. Jahrestreffen der ProcessNet-Fachgruppe CFD (2019), Frankfurt am Main, Germany, March 19–20, 2019.
Wild, S.; Delgado Otalvaro, N.; Guse, D.; Herrera Delgado, K.; Kind, M.; Pitter, S.; Sauer, J.; Karla, H. (2019, May 28). Catalyst performance studies for the direct DME synthesis from variable CO/CO2/H2 feeds. Jahrestreffen Reaktionstechnik gemeinsam mit der Fachgruppe Mehrphasenströmungen (2019), Würzburg, Germany, May 27–29, 2019.
Wörner, M. (2019, September 13). A correlation for the characteristic velocity ratio to predict hydrodynamics of capillary gas-liquid Taylor flow. 6th International Conference on Structured Catalysts and Reactors (ICOSCAR6 2019), Bad Herrenalb, Germany, September 11–13, 2019.
Zimmerlin, B.; Eberhard, M.; Lam, H.; Mai, R.; Michelfelder, B.; Niebel, A.; Otto, T.; Pfitzer, C.; Weih, N.; Willy, M.; Leibold, H.; Dahmen, N.; Kolb, T.; Sauer, J.; Stapf, D. (2019). bioliq®-Pilotanlage zur Herstellung synthetischer Kraftstoffe - Betriebserfahrungen [Vortrag]. DGMK-Fachbereichstagung: Thermochemische Konversion – Schlüsselbaustein für zukünftige Energie- und Rohstoffsysteme (2019), Dresden, Germany, May 23–24, 2019.
Posters
Arnold, U.; Betz, M.; Haltenort, P.; Klein, G.; Sauer, J. (2019). Catalytic Synthesis of Alternative Fuels via Alcohols. 5th International Congress on Catalysis for Biorefineries (CatBior 2019), Turku, Finland, September 23–27, 2019.
Becher, J.; Sheppard, T.; Fam, Y.; Baier, S.; Wang, W.; Wang, D.; Kulkarni, S.; Keller, T.; Lyubomirskiy, M.; Brueckner, D.; Kahnt, M.; Schropp, A.; Schroer, C. G.; Grunwaldt, J.-D. (2019, January). Using Ptychographic X-ray computed tomography and Electron Tomography for 3D structural snapshots of an exhaust gas monolith. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2019), Hamburg, Germany, January 24–25, 2019.
Becher, J.; Sheppard, T.; Meira, D. M.; Sanchez, D. F.; Doronkin, D.; Pascarelli, S.; Grunwaldt, J.-D. (2019, February). Operando Spectrotomographic 3D Imaging of Heterogeneous Catalysts with Energy-Dispersive XAS. ESRF User Meeting (2019), Grenoble, France, February 4–6, 2019.
Becher, J.; Sheppard, T.; Meira, D. M.; Sanchez, D. F.; Doronkin, D.; Pascarelli, S.; Grunwaldt, J.-D. (2019, March). Operando spectrotomographic 3D imaging of structured honeycomb Cu-SSZ-13 exhaust gas catalyst at work. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Börnhorst, M.; Dörnhöfer, J.; Ates, C.; Samkhaniani, N.; Pfeil, J.; Wörner, M.; Koch, R.; Bauer, H.-J.; Deutschmann, O.; Frohnapfel, B.; Koch, T. (2019, September). A Holistic View on Urea Injection for NOxEmission Control: Impingement, Reatomization and Deposit Formation. 6th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VI 2019), Bad Herrenalb, Germany, September 8–10, 2019.
Börnhorst, M.; Homan, T. A. M.; Rohlfs, P.; Deen, N. G.; Deutschmann, O.; Wörner, M. (2019). Cutting of rising bubbles by a wire without contact. Jahrestreffen Reaktionstechnik gemeinsam mit der Fachgruppe Mehrphasenströmungen (2019), Würzburg, Germany, May 27–29, 2019.
Boronin, A.; Stadnichenko, A.; Slavinskaya, E.; Svintsitskiy, D.; Romanenko, A.; Stonkus, O.; Derevyannikova, E.; Svetlichnyi, V.; Marchuk, V.; Doronkin, D.; Casapu, M.; Zimina, A.; Grunwaldt, J.-D. (2019, August). Platinum states and structural features of Pt/Al2O3 catalysts in the NH3 oxidation reaction. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Deschner, B.; Doronkin, D.; Sheppard, T.; Grunwaldt, J.-D.; Dittmeyer, R. (2019, August). In Situ XAS Study of Supported Palladium in the Direct Synthesis of Hydrogen Peroxide in Ethanol-Based Solvents Using a Continuous-Flow High-Pressure Setup. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Fam, Y.; Sheppard, T.; Becher, J.; Scherhaufer, D.; Lambach, H.; Kulkarni, S.; Keller, T.; Wittstock, A.; Wittwer, F.; Seyrich, M.; Brueckner, D.; Kahnt, M.; Schropp, A.; Schroer, C.; Grunwaldt, J.-D. (2019, March). Design of in situ cells for 2D and 3D X-ray and electron microscopy in catalysis research. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Fam, Y.; Becher, J.; Scherer, T.; Marek, P.; Wang, W.; Wang, D.; Wittstock, A.; Sheppard, T. L.; Grunwaldt, J.-D. (2019, February). Multimodal Nanotomography Studies of Heterogeneous Catalysts with Electrons, Ions, and X-rays. KNMF User Meeting (2019), Karlsruhe, Germany, February 19–20, 2019.
Fam, Y.; Sheppard, T. L.; Becher, J.; Weber, S.; Kulkarni, S.; Keller, T.; Schropp, A.; Wittwer, F.; Seyrich, M.; Brueckner, D.; Kahnt, M.; Wittstock, A.; Schroer, C. G.; Grunwaldt, J.-D. (2019). Nanoreactors for in situ X-ray and electron microscopy. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2019), Hamburg, Germany, January 24–25, 2019.
Fan, Y.; Hornung, U.; Dahmen, N.; Kruse, A. (2019). The influence of lipids on the fate of nitrogen during hydrothermal liquefaction of protein-containing biomass. Pyroliq : Pyrolysis and Liquefaction of Biomass and Wastes (2019), Cork, Ireland, June 16–20, 2019.
Gaur, A.; Dabros, T. H.; Høj, M.; Boubnov, A.; Prüssmann, T.; Jelic, J.; Studt, F.; Jensen, A.; Grunwaldt, J.-D. (2019, August). Investigation of the active sites of MoS2 based hydrotreating catalysts by modulated excitation X-ray absorption spectroscopy. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Guo, B.; Yang, B.; Silve, A.; Akaberi, S.; Scherer, D.; Papachristou, I.; Frey, W.; Hornung, U.; Dahmen, N. (2019). Hydrothermal liquefaction of valuables-extracted microalgae with help of pulsed electric field treatment. 27th European Biomass Conference and Exhibition (EUBCE 2019), Lisbon, Portugal, May 27–30, 2019.
Haltenort, P.; Arnold, U.; Sauer, J. (2019). Potentials of Zeolite-catalyzed Transacetalization Reactions of Oxymethylene Dialkyl Ethers. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Haltenort, P.; Malzew, K.; Arnold, U.; Sauer, J. (2019). Catalyst screening and reactive studies for the synthesis of oxymethylene ethers (OME) from dimethyl ether. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Jelic, J.; Gänzler, A.; Maurer, F.; Grunwaldt, J.-D.; Studt, F. (2019, August). DFT study of Pt on CeO₂ under oxidizing and reducing conditions. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Lott, P.; Eck, M.; Doronkin, D. E.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2019, March). Exhaust gas after treatment of natural gas engines: A systematic study on sulfur poisoning and regeneration of methane oxidation catalysts. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Niethammer, B.; Arnold, U.; Sauer, J. (2019). Catalysts for the conversion of dimethyl ether to low-aromatic gasoline. Jahrestreffen Reaktionstechnik gemeinsam mit der Fachgruppe Mehrphasenströmungen (2019), Würzburg, Germany, May 27–29, 2019.
Niethammer, B.; Arnold, U.; Sauer, J. (2019). Modified catalysts for a low-aromatic Dimethyl ether-To-Gasoline process. 12th European Congress of Chemical Engineering (ECCE 2019), Florence, Italy, September 15–19, 2019.
Polierer, S.; Pitter, S.; Grunwaldt, J.-D.; Guse, D.; Delgado, K. H.; Jelic, J.; Kind, M.; Otto, T.; Stehle, M.; Studt, F.; Wild, S.; Zevaco, T.; Zimmermann, M. (2019, March). Synthesis and characterization of copper-based catalysts applied in the one-step dimethyl ether synthesis. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Schade, O.; Kalz, K.; Neukum, D.; Kleist, W.; Grunwaldt, J.-D. (2019). Supported silver catalysts for the selective oxidation of 5-(hydroxymethyl)furfural. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Serrer, M.; Kalz, K.; Saraci, E.; Lichtenberg, H.; Grunwaldt, J.-D. (2019, August). Alloy stability and its role in the enhanced oxygen resistance of a Ni3Fe/Al2O3 catalyst during dynamic CO2 methanation. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Serrer, M.; Zimina, A.; Kalz, K.; Lichtenberg, H.; Grunwaldt, J.-D. (2019, March). Operando XAS and XRD studies of the superior stability of Ni₃Fe/Al₂O₃ under dynamic CO₂ methanation. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Stadnichenko, A.; Slavinskaya, E.; Svintsitskiy, D.; Romanenko, A.; Derevyannikova, E.; Stonkus, O.; Boronin, A.; Svetlichnyi, V.; Marchuk, V.; Doronkin, D.; Casapu, M.; Zimina, A.; Grunwaldt, J.-D. (2019, August). Structure-activity relationships of Pt/TiO2 catalysts for ammonia low-temperature oxidation. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Stehle, M.; Sprenger, P.; Sheppard, T.; Suuronen, J.; Gaur, A.; Benzi, F.; Grunwaldt, J.-D. (2019, March). Monitoring the structural evolution of multicomponent catalysts for selective propylene oxidation. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Stoll, I. K.; Boukis, N.; Sauer, J. (2019). Syngas fermentation at elevated pressure - experimental results. 27th European Biomass Conference and Exhibition (EUBCE 2019), Lisbon, Portugal, May 27–30, 2019.
Straß-Eifert, A.; Sheppard, T.; Damsgaard, C.; Grunwaldt, J.-D.; Güttel, R. (2019, March). Environmental Transmission Electron Microscopy on a Co@HZSM5 Catalyst Active in Fischer-Tropsch Synthesis. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
Tischer, S.; Börnhorst, M.; Amsler, J.; Schoch, G.; Deutschmann, O. (2019, September 8). Thermodynamics and reaction mechanism of urea decomposition. 6th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT VI 2019), Bad Herrenalb, Germany, September 8–10, 2019.
Wang, S.; Doronkin, D.; Zimina, A.; Behrens, S. (2019, August). Bimetallic Nanocrystal-Based Catalysts for the Direct Synthesis of H2O2. 14th European Congress on Catalysis (EuropaCat 2019), Aachen, Germany, August 18–23, 2019.
Woo, M.; Wörner, M.; Deutschmann, O. (2019, September). Influence of liquid film composition on mass transfer in Taylor flow - the case of hydrogenation of nitrobenzene. 6th International Conference on Structured Catalysts and Reactors (ICOSCAR6 2019), Bad Herrenalb, Germany, September 11–13, 2019.
Zengel, D.; Fahami, A.; Günter, T.; Doronkin, D. E.; Casapu, M.; Vuong, T.; Brückner, A.; Grunwaldt, J.-D. (2019, March). The dynamic nature of Cu sites in Cu-SSZ-13 and the origin of the seagull shaped NOx conversion profile during NH3-SCR. 52. Jahrestreffen Deutscher Katalytiker (2019), Weimar, Germany, March 13–15, 2019.
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
PhD Theses
Cavusoglu, G. (2018). Preparation and Characterization of Catalysts for Efficient Hydrogen Production via the High Temperature Water Gas Shift Reaction. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000079508
Gentzen, M. (2018). Multifunktionale nanopartikuläre Katalysatoren als Modellsysteme für die Synthesegaschemie. PhD dissertation. Karlsruher Institut für Technologie (KIT).
Mutz, B. (2018). Methanation of CO₂: Insight into deactivation mechanisms and catalyst stability under dynamic reaction conditions. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000083073
Otromke, M. (2018). Base Catalysed Hydrothermal Reformation of Kraft Lignin. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000083761
Woo, M. (2018). Numerical simulation of gas-liquid Taylor flow with catalyzed heterogeneous reaction. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000078320
Bachelor's Theses
Rohlfs, P. (2018, April 28). Einfluss des Benetzungsverhaltens auf die Blasenzerteilung an einem Zylinder = Influence of the wettability on the bubble cutting by a cylinder. bachelor’s thesis. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000135666
Journal Articles
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
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
Betz, M.; Arnold, U.; Sauer, J. (2018). Synthese von aromatenfreiem Benzin aus Ethanol. Chemie - Ingenieur - Technik, 90 (9), 1169. doi:10.1002/cite.201855080
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
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
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
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
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
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
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
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
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
Etzold, B. J. M.; Nieken, U.; Sauer, J.; Ziegenbalg, D. (2018). Technische Chemie 2017 (Trenbericht). Nachrichten aus der Chemie, 66 (5), 484–485.
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Kaminske, V.; Wiegand, G. (2018). 50 Jahre Plattentektonik: Offene Fragen und mögliche Antworten. Naturwissenschaftliche Rundschau, 71 (3).
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
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
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
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
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
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
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
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
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
Oswald, F.; Stoll, I. K.; Zwick, M.; Herbig, S.; Sauer, J.; Boukis, N.; Neumann, A. (2018). Formic Acid Formation by
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
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
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
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
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
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
Sauer, J.; Klemm, E. (2018). Chemische Reaktionstechnik in Zeiten der Energiewende. Chemie - Ingenieur - Technik, 90 (5), 575. doi:10.1002/cite.201870052
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Conference Papers
Betz, M.; Arnold, U.; Sauer, J. (2018). Synthese von aromatenfreiem Benzin aus Ethanol. 1. Deutsches Doktorandenkolloquium BioenergieDBFZ Tagungsreader, Nr. 13, 172–182, DBFZ.
Fan, Y.; Hornung, U.; Dahmen, N.; Kruse, A. (2018). Formation of n-containing heterocycles from hydrothermal liquefaction of model compounds and sewage sludge. 26th European Biomass Conference and Exhibition, EUBCE 2018; Copenhagen, DK, May 14-17, 2018, 1158–1162, ETA-Florence Renewable Energies. doi:10.5071/26thEUBCE2018-3CV.6.4
Haltenort, P.; Hackbarth, K.; Arnold, U.; Sauer, J. (2018). Aspekte und Beurteilung der sicheren verbrennungsmotorischen Anwendung von Oxymethylenethern (OME). Krafstoffe für die Mobilität von morgen. Hrsg. J. Krahl, 149–150, Cuvillier Verlag.
Oestreich, D.; Haltenort, P.; Hackbarth, K.; Arnold, U.; Sauer, J. (2018). Synthese von Oxymethylenether (OME). Ideen und Innovationen für die Energie von morgen : Wissenschaftliche Beiträge des KIT zu den Jahrestagungen 2014, 2016 und 2017 des KIT-Zentrums Energie. Hrsg.: W. Breh, 107–113, KIT Scientific Publishing. doi:10.5445/IR/1000085345
Wiegand, G.; Böse, A.-S.; Hölscher, H.; Johnsen, S.; Schneider, M.; Syurik, J.; Worgull, M. (2018). Creation of microstructured polymers with defined micro and nano pores for different applications using hot embossing and CO₂. 12th International Symposium on Supercritical Fluids, Antibes-Juan-les-Pins, F, April 22-25, 2018, Paper OA09, ISASF.
Wiegand, G.; Hölscher, H.; Johnsen, S.; Schneider, M.; Syurik, J.; Worgull, M. (2018). Creation of microstructured polymers with defined micro and nano pores for different applications using hot embossing and CO₂ [in press]. 12th International Symposium on Supercritical Fluids (ISSF 2018), Antibes-Juan-les-Pins, F, April 22-25, 2018.
Reports/Preprints
Köppel, W.; Bajohr, S.; Sauer, J.; Heneka, M.; Trudel, N.; Henrich, T. (2018). Vergleichende Bewertung von PtX- Prozessen zur Bereitstellung von Kraftstoffen aus erneuerbaren Quellen.
Presentations
Arnold, U.; Hackbarth, K.; Haltenort, P.; Sauer, J. (2018). refuels – Raw Materials, Processes and Applications for Synthetic Fuels. COMSYN European 2nd Generation Biofuels – Opportunities and Applications 1st Workshop of the European Project COMSYN (2018), Stuttgart/Karlsruhe, April 18–19, 2018.
Arnold, U.; Müller-Langer, F.; Dahmen, N. (2018). Implementation agenda Germany & others”, Commercialization of conventional and advanced liquid biofuels from biomass. IEA Bioenergy Task 39 Business Meeting (2018), Beijing, China, April 7–9, 2018.
Betz, M.; Arnold, U.; Sauer, J. (2018). Synthese von aromatenfreiem Benzin aus Ethanol. 1. Deutsches Doktorandenkolloquium Bioenergie (2018), Leipzig, Germany, September 20–21, 2018.
Boukis, N. (2018). Fermentation: Eine neue Alternative für die Nutzung von Synthesegasen. Umsichtige Industrielösungen : Fraunhofer UMSICHT Sommersymposium (2018), Sulzbach-Rosenberg, Germany, June 28, 2018.
Boukis, N.; Herbig, S.; Sauer, J. (2018). Gasification of wet waste biomass in supercritical water, selected examples. 9th International Freiberg Conference on IGCC & XtL (2018), Berlin, Germany, June 3–8, 2018.
Cai, X.; Wu, Y.; Marschall, H.; Deutschmann, O.; Frohnapfel, B.; Wörner, M. (2018, March 7). Numerical simulation campaign on droplet rebound from hydrophobic surface. Jahrestreffen der ProcessNet-Fachgruppen Mehrphasenströmungen, Wärme- und Stoffübertragung und Computational Fluid Dynamics (2018), Bremen, Germany, March 6–7, 2018.
Cai, X.; Wörner, M.; Frohnapfel, B. (2018). Numerische Simulation von Tropfenaufprallvorgängen im Hinblick auf die Bildung von Flüssigkeitsfilmen bei der SCR Abgasnachbehandlung. Boysen Doktoranden-Treffen (2018), Altensteig, Germany, May 17–18, 2018.
Cavusoglu, G.; Dallmann, F.; Lichtenberg, H.; Castro, G. R.; Dittmeyer, R.; Grunwaldt, J.-D. (2018). Investigstion of a Rh/CeO₂ catalyst and a Pd membrane in a micro-structured membrane reactor. 17th International Conference on X-Ray Absorption Fine Structure (XAFS 2018), Krakow, Poland, July 22–27, 2018.
Dietze, E.; Abild-Petersen, F.; Plessow, P. N. (2018). Insights into the relative importance of ripening and particle migration for sintering of Pt nanoparticles. DPG-Frühjahrstagung der Sektion Kondensierte Materie gemeinsam mit der EPS (2018), Berlin, Germany, March 11–16, 2018.
Doronkin, D. E.; Benzi, F.; Becher, J.; Sheppard, T. L.; Gänzler, A. M.; Grunwaldt, J. D. (2018). Pt-based diesel oxidation catalysts studied by X-ray absorption spectroscopy during rapid transient temperature driving cycles. 11th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2018), Brussels, Belgium, October 29–31, 2018.
Doronkin, D. E.; Günter, T.; Fahami, A. R.; Casapu, M.; Grunwaldt, J.-D. (2018). Origins of the ’Seagull’ NOx conversion profile during selective catalytic reduction by ammonia over Cu-SSZ-13 catalysts. 27th ATC: Industrial Inorganic Chemistry - Materials and Processes (2018), Frankfurt am Main, Germany, February 22–23, 2018.
Doronkin, D. E.; Günter, T.; Fahami, A. R.; Tronconi, E.; Nova, I.; Casapu, M.; Grunwaldt, J. D. (2018). NH₃-SCR over V-W/TiO₂ investigated by operando X-ray absorption and emission spectroscopy. 11th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2018), Brussels, Belgium, October 29–31, 2018.
Doronkin, D. E.; Günter, T.; Fahami, A. R.; Tronconi, E.; Nova, I.; Casapu, M.; Grunwaldt, J. D. (2018). Dynamics of Cu sites and the origin of dual-maxima NOₓ conversion profile during NH₃-SCR over Cu-SSZ-13. 11th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2018), Brussels, Belgium, October 29–31, 2018.
Gentzen, M.; Behrens, S.; Sauer, J. (2018). Model catalyst for the direct synthesis of DME from CO-rich synthesis gas by colloidal preparation techniques. Japan-German Joint Symposium on Advanced Catalysis Materials and Characterization (2018), Munich, Germany, June 19–21, 2018.
Giehr, A.; Angeli, S.; Maier, L.; Deutschmann, O. (2018). Experimental and microkinetic investigation of methane dry reforming on a co-based catalyst. 117th General Assembly of the German Bunsen Society for Physical Chemistry (2018), Hanover, Germany, May 10–12, 2018.
Giehr, A.; Angeli, S.; Maier, L.; Deutschmann, O. (2018). Experimental and microkinetic investigation of methane dry reforming on a Co-based catalyst. 51. Jahrestreffen Deutscher Katalytiker (2018), Weimar, Germany, March 14–16, 2018.
Giehr, A.; Angeli, S.; Maier, L.; Schunk, S.; Deutschmann, O. (2018). Dry reforming of methane over a Co-based catalyst: An experimental and microkinetics modeling study. 25th International Conference on Chemical Reaction Engineering (ISCRE 2018), Florence, Italy, May 20–23, 2018.
Gossler, H.; Maier, L.; Angeli, S.; Tischer, S.; Deutschmann, O. (2018). CaRMeN: a novel software tool for the evaluation of kinetic models. 117th General Assembly of the German Bunsen Society for Physical Chemistry (2018), Hanover, Germany, May 10–12, 2018.
Gossler, H.; Angeli, S.; Tischer, S.; Maier, L.; Deutschmann, O. (2018). Catalytic reaction mechanism network (CaRMeN): a novel tool for the evaluation of kinetic data and mechanisms. 51. Jahrestreffen Deutscher Katalytiker (2018), Weimar, Germany, March 14–16, 2018.
Gossler, H.; Maier, L.; Angeli, S.; Tischer, S.; Deutschmann, O. (2018). Reaction mechanisms for combustion of H₂, CO and CH₄ over Rh analyzed by CaRMeN. 37th International Symposium on Combustion (2018), Dublin, Ireland, July 29–August 3, 2018.
Gossler, H.; Tischer, S.; Maier, L.; Deutschmann, O. (2018). CaRmeN: catalytic reaction mechanisms network - a novel tool for the evaluation of kinetic data and mechanisms. 25th International Conference on Chemical Reaction Engineering (ISCRE 2018), Florence, Italy, May 20–23, 2018.
Grunwaldt, J.-D.; Doronkin, D. E.; Zheng, L.; Benzi, F.; Casapu, M. (2018). Operando X-ray absorption and emission spectroscopic study if V-W-TiO₂ catalysts for NOₓ removal from the diesel exhaust. 17th International Conference on X-Ray Absorption Fine Structure (XAFS 2018), Krakow, Poland, July 22–27, 2018.
Grunwaldt, J.-D.; Gentzen, M.; Doronkin, D. E.; Sheppard, T. L.; Sauer, J.; Behrens, S. (2018). High pressure operando XANES and EXAFS investigation of a bifunctional PdZn catalyst prepared by a colloidal route during synthesis of dimethyl ether. 17th International Conference on X-Ray Absorption Fine Structure (XAFS 2018), Krakow, Poland, July 22–27, 2018.
Guo, B.; Hornung, U.; Dahmen, N. (2018). A mechanism study of microalgae hydrothermal liquefaction by means of pyrolysis, gas chromatography, mass spectrometry, and thermogravimetric analysis. 2nd International Conference on Marine Biomass as Renewable Energy (2018), Glasgow, United Kingdom, March 5–6, 2018.
Hackbarth, K.; Haltenort, P.; Lautenschütz, L.; Oestreich, D.; Arnold, U.; Sauer, J. (2018). Oxymethylene ethers (OMEs): Alternative diesel fuels for clean combustion. 4th International Symposium on Catalysis for Clean Energy and Sustainable Chemistry (CCESC 2018), Bilbao, Spain, July 9–11, 2018.
Ille, Y.; Hamberger, P.; Sanchez, F.; Funke, A.; Pereda, S.; Dahmen, N.; Schaber, K. (2018). Modelling of the Condensation of Fast Pyrolysis Vapours including Aerosol Formation. 22nd International Symposium on Analytical and Applied Pyrolysis (Pyro 2018), Kyoto, Japan, June 3–8, 2018.
Kaczowka, E.; Büchner, J.; WIegand, G.; Sauer, J. (2018). Automatisierte online-Analyse wässriger Zweiphasensysteme unter Druck und Temperatur. Jahrestreffen der ProcessNet-Fachgruppe Hochdruckverfahrenstechnik (2018), Erlangen, Germany, February 20–21, 2018.
Kerkeni, B.; Berthout, D.; Chizallet, C.; Doronkin, D. E.; Casapu, M.; Grunwaldt, J. D.; Berthomieu, D. (2018). Metal coordination in CuII-SSZ-13 exposed to NH₃: DFT with in situ XAS experiment studies. 17 International Conference on Theoretical Aspects of Catalysis (ICTAC 2018), Los Angeles, CA, USA, June 24–28, 2018.
Kerkeni, B.; Berthout, D.; Chizallet, C.; Doronkin, D. E.; Casapu, M.; Grunwaldt, J. D.; Berthomieu, D. (2018). Copper coordination to ammonia in CuII-exchanged SSZ-13: atomistic insights from DFT calculations on in situ XAS experiments. 11th International Congress on Catalysis and Automotive Pollution Control (CAPoC 2018), Brussels, Belgium, October 29–31, 2018.
Lichtenberg, H.; Serrer, M. A.; Mutz, B.; Lefebvre, J.; Bajohr, S.; Kolb, T.; Grundwaldt, J. D. (2018). Synchrotron-based operando studies of Ni-based catalysts for methanation of CO₂. 17th International Conference on X-Ray Absorption Fine Structure (XAFS 2018), Krakow, Poland, July 22–27, 2018.
Mutz, B.; Gänzler, A.; Kalz, K. F.; Grunwaldt, J.-D. (2018). Catalysts and reactors under dynamic reaction conditions: Impact on structure and activity. 4th International Symposium onChemistry for Energy Conversionand Storage (2018), Berlin, Germany, January 28–31, 2018.
Mutz, B.; Sprenger, P.; Wang, W.; Wang, D.; Kleist, W.; Grunwaldt, J.-D. (2018). Operando Raman spectroscopy on CO₂ methanation over Ni/Al₂O₃ catalysts: Role of carbon formation as possible deactivation pathway. 51. Jahrestreffen Deutscher Katalytiker (2018), Weimar, Germany, March 14–16, 2018.
Schade, O. R.; Kalz, K. F.; Grunwaldt, J. D. (2018). Oxidation of 5-(hydroxymethyl)furfural (HMF) over gold- and silver-based catalysts. 51. Jahrestreffen Deutscher Katalytiker (2018), Weimar, Germany, March 14–16, 2018.
Schmitt, C. C.; Boscagli, C.; Raffelt, K.; Rapp, M.; Dahmen, N. (2018). Hydrotreatment of bio-oil for fuel and chemicals production. Biomass and Bioenergy Conference (2018), Sorocaba, Brazil, April 10–12, 2018.
Schmitt, C. C.; Rapp, M.; Raffelt, K.; Dahmen, N. (2018). Hydrotreatment of the heavy phase fraction of beech wood pyrolysis oil over nickel catalysts. 2nd International Conference on Catalysis and Chemical Engineering (2018), Paris, France, February 19–21, 2018.
Schuler, J.; Hornung, U.; Dahmen, N.; Sauer, J. (2018). Ligninverflüssigung - ein Vergleich verschiedener Reaktortypen. ProcessNet-Jahrestagung und 33. DECHEMA-Jahrestagung der Biotechnologen (2018), Aachen, Germany, September 10–13, 2018.
Serrer, M. A.; Mutz, B.; Belimov, M.; Pfeifer, P.; Kleist, W.; Kalz, K. F.; Lichtenberg, H.; Grunwaldt, J. D. (2018). Potential of Ni₃Fe/Al₂O₃ catalyst in the methanation of CO₂. 51. Jahrestreffen Deutscher Katalytiker (2018), Weimar, Germany, March 14–16, 2018.
Serrer, M. A.; Mutz, B.; Kalz, K. F.; Lichtenberg, H.; Lefebvre, J.; Loewert, M.; Kirsch, H.; Pfeifer, P.; Bajohr, S.; Kolb, T.; Dittmeyer, R.; Grunwaldt, J. D. (2018). Synchrotron based operando characterization of Ni- and Co-based P2X catalysts. 9th International Freiberg Conference on IGCC & XtL (2018), Berlin, Germany, June 3–8, 2018.
Stoll, I. K.; Herbig, S.; Zwick, M.; Boukis, N.; Sauer, J.; Neumann, A.; Oswald, F. (2018). Fermantation of H₂ and Co₂ with Clostridium ljungdahlii at Elevated Process Pressure - First Experimental Results. 6th International Conference on Industrial Biotechnology (2018), Venice, Italy, April 15–18, 2018.
Stroh, A.; Fink, V.; Cai, X.; Bernard, R.; Kriegseis, J.; Frohnapfel, B.; Marschall, H.; Wörner, M. (2018). Numerical simulation of drop impact and rebound phenomena on smooth and micro-structured hydrophobic surfaces. 5. bwHPC Symposium (2018), Freiburg, Germany, September 24–25, 2018.
Tofighi, G.; Dolcet, P.; Lichtenberg, H.; Wang, W.; Rinke, G.; Dittmeyer, R.; Grunwaldt, J. D. (2018). Microfluidic synthesis of Au, Pd and AuₓPdy nanoparticles nd in situ XAS studies of Au NP formation in a continuous flow. 15th International Conference on Microreaction Technology (IMRET 2018), Karlsruhe, Germany, October 21–24, 2018.
Wiegand, G.; Hölscher, H.; Johnsen, S.; Syurik, J. (2018). Creation of microstructured polymers with defined micro and nano pores for different applications using hot embossing and CO₂. 12th International Symposium on Supercritical Fluids (ISSF 2018), Antibes, France, April 22–25, 2018.
Posters
Baehr, C.; Raffelt, K.; Dahmen, N. (2018, May 14). Stabilization of pyrolysis oils by solvent additions. 26th European Biomass Conference and Exhibition (EUBCE 2018), Copenhagen, Denmark, May 14–17, 2018.
Baehr, C.; Raffelt, K.; Dahmen, N. (2018, June 3). Stabilization of pyrolysis oils by solvent additions. 22nd International Symposium on Analytical and Applied Pyrolysis (Pyro 2018), Kyoto, Japan, June 3–8, 2018.
Betz, .; Arnold, U.; Sauer, J. (2018). Production of gasoline from ethylene. 6th Internationale Tailor-Made Fuels- From Production to Propulsion (TMFB 2018), Aachen, Germany, June 19–21, 2018.
Betz, M.; Arnold, U.; Sauer, J. (2018). Synthese von aromatenfreiem Benzin aus Ethanol. ProcessNet-Jahrestagung und 33. DECHEMA-Jahrestagung der Biotechnologen (2018), Aachen, Germany, September 10–13, 2018.
Dieguez-Alonso, A.; Anca-Couce, A.; Funke, A.; Almuina-Villar, H.; Behrendt, F. (2018). Influence of pyrolysis conditions on biochar properties: Potential pathways to engineer biochar. 22nd International Symposium on Analytical and Applied Pyrolysis (Pyro 2018), Kyoto, Japan, June 3–8, 2018.
Haltenort, P.; Hackbarth, K.; Arnold, U.; Sauer, J. (2018). Aspekte und Beurteilung der sicheren verbrennungsmotorischen Anwendung von Oxymethylenethern (OME). 3. Tagung der Fuels Joint Research Group (FJRG 2018), Brunswick, Germany, September 20–21, 2018.
Ille, Y.; Pfitzer, C.; Dahmen, N.; Niebel, A.; Weih, N.; Zimmerlin, B. (2018). Operational Experience and Technical Modifications at the bioliq® Fast Pyrolysis Plant. 22nd International Symposium on Analytical and Applied Pyrolysis (Pyro 2018), Kyoto, Japan, June 3–8, 2018.
Mutz, B.; Serrer, M. A.; Belimov, M.; Pfeifer, P.; Kleist, W.; Kalz, K. F.; Grunwaldt, J. D. (2018). Performance and stability of a Ni₃Fe/Al₂O₃ catalyst in the methanation of CO₂. 4th International Symposium onChemistry for Energy Conversionand Storage (2018), Berlin, Germany, January 28–31, 2018.
Pruessmann, T.; Lichtenberg, H.; Zimina, A.; Mutz, B.; Serrer, M. A.; Grunwaldt, J.-D. (2018). Combination of kinetic and structural studies of catalysts at the CAT-ACT X-ray spectroscopy beamline at KIT. 17th International Conference on X-Ray Absorption Fine Structure (XAFS 2018), Krakow, Poland, July 22–27, 2018.
Pruessmann, T.; Zimina, A.; Lichtenberg, H.; Serrer, M. A.; Doronkin, D.; Grunwaldt, J.-D. (2018). Combination of kinetic and structural studies of catalysts at the CAT-ACT X-ray spectroscopy beamline at KIT. German conference for research with synchrotron radiation, neutrons and ion beams at large facilities (SNI 2018), Munich, Germany, September 17–19, 2018.
Schade, O.; Kalz, K.; Neukum, D.; Geng, P.; Kleist, W.; Grunwaldt, J.-D. (2018). Gold- and silver-catalyzed oxidation of 5-(hydroxymethyl)furfural. 18th Nordic Symposium on Catalysis (NSC 2018), Copenhagen, Denmark, August 26–28, 2018.
Schmitt, C. C.; Gagliardi Reolon, M. B.; Raffelt, K.; Dahmen, N. (2018). Síntese e regeneração de catalisadores de níquel para hidrotratamento de bio-óleos de pirólise rápida. 26. Congresso Ibero-Americano de Catálise (2018), Coimbra, Portugal, September 9–14, 2018.
Schmitt, C. C.; Gagliardi Reolon, M. B.; Raffelt, K.; Grunwaldt, J.-D.; Dahmen, N. (2018). Synthesis and reuse of nickel-based catalysts for upgrading of pyrolysis oil. 18th Nordic Symposium on Catalysis (NSC 2018), Copenhagen, Denmark, August 26–28, 2018.
Schmitt, C. C.; Moreira, R.; Cruz Neves, R.; Funke, A.; Raffelt, K.; Dahmen, N. (2018). Upgrading of pyrolysis-oil produced from sugarcane biorefinery residues. Biomass and Bioenergy Conference (2018), Sorocaba, Brazil, April 10–12, 2018.
Schmitt, C. C.; Rapp, M.; Raffelt, K.; Dahmen, N. (2018). Mild and deep hydrodeoxygenation of pyrolysis oil over nickel catalysts. 26th European Biomass Conference and Exhibition (EUBCE 2018), Copenhagen, Denmark, May 14–17, 2018.
Serres, M.; Jamshidi, F.; Cai, X.; Marschall, H.; Deutschmann, O.; Philippe, R.; Vidal, V.; Wörner, M. (2018). Taylor flow entering a porous medium: experiment and simulation. 15th International Conference on Microreaction Technology (IMRET 2018), Karlsruhe, Germany, October 21–24, 2018.
Stoll, K. I.; Boukis, N.; Sauer, J. (2018). Syngas fermentation. A biotechnological way to utilize synthesis gas. 26th European Biomass Conference and Exhibition (EUBCE 2018), Copenhagen, Denmark, May 14–17, 2018.
Wodarz, S.; Slaby, N. A.; Zimmermann, M. C.; Otto, T. N.; Sauer, J. (2018). Shaped hierarchical H-ZSM-5 catalysts for conversion of dimethyl ether to gasoline. 30. Deutsche Zeolith-Tagung gemeinsam mit dem Jahrestreffen der ProcessNet-Fachgruppe Adsorption (2018), Kiel, Germany, February 28–March 2, 2018.
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
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
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
Raffelt, K.; Nicoleit, T.; Dahmen, N.; Sauer; Joerg. (2017). Bio-Slurries From Lignocellulose. Encyclopedia of Sustainable Technologies. Ed. by Abraham, Martin, 217–228, Elsevier.
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
PhD Theses
Boscagli, C. (2017). Hydrotreatment of pyrolysis oils over nickel-based catalysts. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000070739
Nicoleit, T. (2017). Konditionierung von biogenen Energieträgern aus den Produkten der bioliq®-Schnellpyrolyse. PhD dissertation. KIT Scientific Publishing. doi:10.5445/KSP/1000058225
Oestreich, D. (2017). Prozessentwicklung zur Gewinnung von Oxymethylenethern (OME) aus Methanol und Formaldehyd. PhD dissertation. KIT Scientific Publishing. doi:10.5445/KSP/1000069417
Oestreich, D. (2017). Prozessentwicklung zur Gewinnung von Oxymethylenethern (OME) aus Methanol und Formaldehyd. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000068867
Master's Theses
Wu, Y. (2017, September 15). Numerical Simulation of Droplet Impact and Rebound on a Wall. master’s thesis. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000079141
Journal Articles
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Funke, A. (2017). Comparison of intermediate and fast pyrolysis in screw-type reactors. PyNe Newsletter, (41), 3–5.
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
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
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
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
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
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
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
Kalz, K. F.; RalphKraehnert; MuslimDvoyashkin; RolandDittmeyer; 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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Conference Papers
Arnold, U.; Lautenschütz, L.; Haltenort, P.; Niethammer, B.; Oestreich, D.; Sauer, J. (2017). Alternative Diesel Fuels : Feedstocks, Production and Potentials. Fuels : Conventional and Future Energy for Automobiles : Proceedings of the 11th International Colloquium, Ostfildern, Germany, 27th - 29th June 2017. Ed.: N. Schubert, 333–337, Technische Akademie Esslingen (TAE).
Baehr, C.; Gulden, J.; Raffelt, K.; Dahmen, N. (2017). Carbon dioxide as a solvent for pyrolysis oils. Proceedings of the 25th European Biomass Conference & Exhibition, Stockholm/Schweden, 12.06.-15.06.17.
Boukis, N.; Stoll, I. K.; Sauer, J.; Fischer, J.; Kansy, R. (2017). Separation of salts during the gasification of spent grain in supercritical water. 25th European Biomass Conference and Exhibition, Stockholm, Sweden, 12.-15. June 2017, 338–343, Stockholm.
Carriel-Schmitt, C.; Boscagli, C.; Rapp, M.; Raffelt, K.; Dahmen, N. (2017). Characterization of Light and Heavy Phase of Pyrolysis-Oil from Distinct Biomass for Further Upgrading Reactions. Proceedings of the 25th European Biomass Conference & Exhibition, Stockholm/Schweden, 12.06.-15.06.17, 1143–1147. doi:10.5071/25thEUBCE2017-3AV.3.15
Haltenort, P.; Lautenschütz, L.; Oestreich, D.; Hackbarth, K.; Arnold, U.; Sauer, J. (2017). Optimized Synthesis of Oxymethylene Dimethyl Ethers (OMEs) from Dimethoxymethane and Trioxane. From Production to Propulsion : TMFB 5th International Conference 2017, Book of Abstracts, Eurogress, Aachen, Germany, 20th - 22nd June 2017, 69–71.
Haltenort, P.; Oestreich, D.; Lautenschütz, L.; Arnold, U.; Sauer, J. (2017). Production of Oxymethylene Dimethyl Ethers (OMEs) : Process Development by Reactive System Studies. Jahrestreffen Reaktionstechnik 2017, Tagungszentrum Festung Marienberg, Würzburg, Deutschland, 22. - 24. Mai 2017, 56–57.
Kaczowka, E.; Wiegand, G.; Sauer, J. (2017). Investigation of saline hydrothermal phases in geothermal brines - modelling and experimental approaches. Proceedings of the 2nd RESRB 2017 Conference, Wroclaw, PL, June 19-21, 2017. Ed. W. Budzianowski, 45, bp bepress.
Lautenschütz, L.; Oestreich, D.; Haltenort, P.; Arnold, U.; Sauer, J. (2017). Catalytic Processes for the Production of Oxymethylene Ethers (OMEs). North American Catalysis Society Meeting 2017 (NAM25), Denver, Colorado, 4th - 9th June 2017, S. 139.
Moreira, R.; Cruz-Neves, R.; Carriel-Schmitt, C.; Breunig, M.; Coelho Tambani, P.; Ushima, A. H.; Funke, A.; Raffelt, K. (2017). Characterization of Brazilian Sugarcane Bagasse and Sugarcane Straw Based on European Methodologies to Evaluate the Potential for Energy Conversion. Proceedings of the 25th European Biomass Conference & Exhibition, Stockholm/Schweden, 12.06.-15.06.17, 150–155. doi:10.5071/25thEUBCE2017-1DV.1.6
Oestreich, D.; Arnold, U.; Sauer, J. (2017). Synthesis of oxymethylene ethers (OME) : An innovative and environmental friendly diesel fuel. 50. Jahrestreffen Deutscher Katalytiker, Book of Abstracts, Weimar, Deutschland, 15. - 17. März 2017, 67–68.
Oestreich, D.; Hackbarth, K.; Haltenort, P.; Arnold, U.; Sauer, J. (2017). Fuels from Renewable Raw Materials : OME Synthesis and Properties. Preprints of the DGMK-Conference "Petrochemistry and Refining in a Changing Raw Materials Landscape", Dresden, Germany, 9th - 11th October 2017. Ed.: S. Ernst, 47–52, Deutsche Wissenschaftliche Gesellschaft für Erdöl, Erdgas und Kohle e.V. (DGMK).
Oyedun, A. O.; Kumar, A.; Oestreich, D.; Arnold, U.; Sauer, J. (2017). Production of Oxymethylene Ether (OME) from Different Lignocellulosic Biomass : A Comparative Techno-economic Assessment. From Production to Propulsion : TMFB 5th International Conference 2017, Eurogress, Aachen, Germany, 20th - 22nd June 2017, 91–94.
Rosenthal, F.; Kubach, H.; Koch, T.; Arnold, U. (2017). Minimalmengeneinspritzung reaktiver Kraftstoffe zur Zündung von Gasmotoren mit Magerbrennverfahren oder Hoch-AGR-Konzept = Minimal Quantity Injection of reactive fuels as ignition for gas engines with lean burn or high EGR concept. 10. Dessauer Gasmotorenkonferenz, Dessau-Roßlau, Germany, 6. - 7. April 2017, 201–214.
Schmitt, C. C.; Rapp, M.; Voigt, A.; Dahmen, N. (2017). Detection of aromatic compounds in artificial gasoline with hybrid surface acoustic wave sensor array and a short packed column (SAW-GC). 15th IEEE Sensors Conference, SENSORS 2016, Orlando, FL, October 30 - November 2, 2016. Ed.: H. Rahmani, Article: 7808605, Institute of Electrical and Electronics Engineers (IEEE). doi:10.1109/ICSENS.2016.7808605
Schuler, J.; Hornung, U.; Sauer, J. (2017). The Challenge of Lignin as a Chemical Resource. Proceedings of the 25th European Biomass Conference and Exhibition, EUBCE 2017, Stockholm, Sweden, 12th - 15th June 2017, 987–991, ETA-Florence Renewable Energies. doi:10.5071/25thEUBCE2017-3BO.15.3
Suwelack, K.; Kruse, A.; Dahmen, N. (2017). Socio-economic assessment including feedstock supply and marketability concept of HTC/HTL-products. Proceedings of the 25th European Biomass Conference and Exhibition, EUBCE 2017, Stockholm, Sweden, 12th - 15th June 2017, 1550–1559, ETA-Florence Renewable Energies.
Weih, N.; Funke, A.; Ille, Y.; Pfitzer, C.; Niebel, A.; Dahmen, N. (2017). Online balancing of a pilot scale fast pyrolysis plant. 25th European Biomass Conference and Exhibition - Setting the course for a biobased economy - EUBCE, Stockholm, Sweden, 12-15 June 2017. Ed.: L. Ek, ETA-Florence Renewable Energies.
Wodarz, S.; Otto, T.; Zimmermann, M.; Sauer, J. (2017). Synthesis of gasoline-range hydrocarbons from dimethyl ether with hierarchical zeolite catalysts. Fuels - Conventional and Future Energy for Automobiles : 11th Colloquium, Stuttgart, 27.-29.Juni 2017. Proceedings, Technische Akademie Esslingen (TAE).
Presentations
Arnold, U. (2017). Alternative Diesel Fuels : Feedstocks, Production and Potentials. Fuels - Conventional and Future Energy for Automobiles : 11th International Colloquium, Ostfildern, Germany, 27th - 29th June 2017.
Arnold, U.; Dahmen, N.; Delgado, K. H.; Gentzen, M.; Oestreich, D.; Sauer, J. (2017, June 20). The Long Road to Commercial Fuels for Internal Combustion Engines from Regenerative Sources. Tailor-Made Fuels - From Production to Propulsion, 5th International Conference, 20.-22 Juni 2017, Aachen (D).
Arnold, U.; Dahmen, N.; Oestreich, D.; Haltenort, P.; Sauer, J. (2017). Oxygenate für die Anwendung im Dieselmotor: Rohstoffe, Eigenschaften, Herstellverfahren. Infotag Oxymethylenether, Frankfurt, 5. April 2017.
Arnold, U.; Sauer, J.; Burger, J.; Hasse, H.; Härtl, M.; Wachtmeister, G. (2017). Entwicklung von Oxymethylenethern im FNR-Projekt Umweltfreundliche Dieseladditive aus nachwachsenden Rohstoffen. Infotag Oxymethylenether, Frankfurt, 5. April 2017.
Cai, X.; Wörner, M.; Frohnapfel, B. (2017). Numerische Simulation von Tropfenaufprallvorgängen im Hinblick auf die Bildung von Flüssigkeitsfilmen bei der SCR Abgasnachbehandlung. Boysen Doktorandentage, Altensteig, 11.-12.Mai 2017.
Cai, X.; Wu, Y.; Wörner, M.; Frohnapfel, B. (2017). Numerical Study of Droplet Impact and Rebound on Hydrophobic Surface. 70th Annual Meeting of the American Physical Society, Division of Fluid Dynamics (2017), Denver, CO, USA, November 19–21, 2017.
Carriel Schmitt, C.; Yigit, Z.; Moreira, R.; Raffelt, K.; Rapp, M.; Dahmen, N. (2017). Extraction, characterization and evaluation of pyrolytic lignin from beech wood bio-oil for application as a bio-based raw material. 13th International conference on renewable resources and biorefineries (2017), Wrocław, Poland, June 7–9, 2017.
Doronkin, D. E.; Cavusoglu, G.; Lichtenberg, H.; Grunwaldt, J. D. (2017). Pt-based catalysts made by flame spray pyrolysis for catalytic partial oxidation of methane. 8th World Congress on Oxidation Catalysis (WCOC 2017), Krakow, PL, September 3-8, 2017.
Doronkin, D. E.; Günter, T.; Fahami, A. R.; Casapu, M.; Grunwaldt, J. D. (2017). Dynamics of Cu sites and the origin of dual-maxima NOₓ conversion profile during NH₃-SCR over CU-SSZ-13 revealed by operando X-ray spectroscopy. The Zeolites : Materials with Engineered Properties, 7th FEZA Conference, Sofia, BG, July 3-7, 2017.
Doronkin, D. E.; Selinsek, M.; Deschner, B. J.; Sheppard, T. L.; Lichtenberg, H.; Dittmeyer, R. (2017). Operando XAS study of a Pd/TiO₂ catalyst in the direct synthesis of H₂O₂. 8th World Congress on Oxidation Catalysis (WCOC 2017), Krakow, PL, September 3-8, 2017.
Fink, V.; Bernard, R.; Marschall, H.; Wörner, M.; Frohnapfel, B.; Cai, X. (2017). Simulation of drop impact on structured surfaces. Jahrestreffen der ProcessNet-Fachgruppen Mehrphasenströmungen, Partikelmesstechnik, Zerkleinern und Klassieren, Computational Fluid Dynamics, Mischvorgänge und dem TAK Aerosoltechnologie, Dresden, 14.-17.März 2017.
Frei, E.; Heine, C.; Friedrich, M.; Greiner, M.; Lunkenbeim, T.; Schumann, J.; Trunschke, A.; Lichtenberg, H.; Gaur, A.; Grunwaldt, J.-D.; Schlögl, R. (2017). Much more the reduction - activating a Cu/ZnO:Al catalyst: Decomposition, self-doping and polymorphism. 13th European Congress on Catalysis (EUROPACAT 2017), Florence, Italy, August 27–31, 2017.
Funke, A.; Grandl, R.; Dahmen, N.; Sauer, J. (2017). Factor 50 – A Combined Experimental and Theoretical Evaluation of Fast Pyrolysis Scale Up. 5th International Conference on Thermochemical Conversion Science (TcBiomass 2017), Chicago, IL, September 19-21, 2017.
Funke, A.; Joschko, D.; Nägele, H.-J. (2017). Hydrothermal carbonization of digestate. Process integration of biogas plants. 1st International Symposium on Hydrothermal Carbonisation (2017), London, United Kingdom, April 3–4, 2017.
Giehr, A.; Maier, L.; Schunk, S. A.; Deutschmann, O. (2017). Methane dry reforming over Co catalyst: Thermodynamic analysis and experimental kinetic study. 25th 25th North American Catalysis Society Meeting (2017), Denver, CO, USA, June 4–9, 2017.
Giehr, A.; Maier, L.; Schunk, S. A.; Deutschmann, O. (2017). Comparative thermodynamic considerations on oxidation state and coking resistance of Co/Al₂O₃ and Nl/Al₂O₃ catalysts under dry/steam reforming conditions. 50.Jahrestreffen Deutscher Katalytiker, Weimar, 15.-17.März 2017.
Grandl, R.; Funke, A.; Dahmen, N.; Sauer, J. (2017). Schnellpyrolyse von Biomasse im Doppelschneckenmischreaktor: Lagrange-Euler-Simulation zur Charakterisierung von Stoff- und Energietransportvorgängen. Jahrestreffen Dresden - Jahrestreffen der ProcessNet-Fachgruppen Mehrphasenströmungen, Partikelmesstechnik, Zerkleinern und Klassieren, Computational Fluid Dynamics, Mischvorgänge und dem TAK Aerosoltechnologie. Dresden, 14.-17. März 2017.
Guo, B.; Silve, A.; Frey, W.; Hornung. Ursel; Dahmen, K. (2017). Hydrothermal liquefaction of raw and components-extracted microalgae with assist of pulsed electric field pretreatment. 2nd International Bioeconomy Congress, Stuttgart-Hohenheim, 12.-13.09.2017.
Guo, B.; Silve, A.; Gusbeth, C.; Frey, W.; Hornung. Ursel; Dahmen, K. (2017). Hydrothermal liquefaction of raw and components-extracted microalgae with assist of pulsed electric field pretreatment. 25th European Biomass Conference and Exhibition (2017), Stockholm, Sweden, June 12–15, 2017.
Hähsler, M.; Appel, I.; Eremin, A.; Stannarius, R.; Behrens, S. (2017). Stable suspensions of magnetic nanoparticles in thermotropic liquid crystals. 16th German Ferrofluid Workshop (2017), Dresden, Germany, July 17–19, 2017.
Haltenort, P. (2017). Optimized Synthesis of Oxymethylene Dimethyl Ethers (OMEs) from Dimethoxymethane and Trioxane. From Production to Propulsion : TMFB 5th International Conference 2017, Eurogress, Aachen, Germany, 20th - 22nd June 2017.
Haltenort, P. (2017). Production of Oxymethylene Dimethyl Ethers (OMEs) : Process Development by Reactive System Studies. Jahrestreffen Reaktionstechnik 2017, Tagungszentrum Festung Marienberg, Würzburg, Deutschland, 22. - 24. Mai 2017.
Hornung, U. (2017). Grenzen der HTL. HTP-Fachforum, Leipzig, 12.-13. September.
Ille, Y.; Hamberger, P.; Dahmen, N.; Schaber, K. (2017). Modellierung der Kondensation von Pyrolysedämpfen unter Berücksichtigung von Aerosolbildung. 11. Kolloquium Sustainable BioEconomy (2017), Karlsruhe, Germany, December 5, 2017.
Ille, Y.; Sanchez, F.; Dahmen, N.; Pereda, S. (2017). Thermodynamic modelling of fast pyrolysis bio-oils by group contribution. 10th World Congress of Chemical Engineering (2017), Barcelona, Spain, October 1–5, 2017.
Jörg Sauer. (2017, September 22). Aspects of the Future Anthropogenic Carbon Cycle. Future of Energy Conference, Edmonton (CA), 21.-22. September 2017.
Lichtenberg, H.; Grunwaldt, J.-D. (2017). Operando XAS studies on catalysts for energxy related processes. 24th Congress and General Assembly of the International Union of Crystallography, Hyderabad, IND, August 21-28, 2017.
Marschall, H.; Deising, D.; Pesci, C.; Cai, X.; Wörner, M.; Deutschmann, O.; Bothe, D. (2017, June 27). Direct Numerical Simulation of Bubbly Flows. 3rd International Conference on Numerical Methods in Multiphase Flows (ICNMMF 2017), Tokyo, Japan, June 26–29, 2017.
Mutz, B.; Gänzler, A. M.; Sprengler, P.; Carvalho, H. W. P.; Kalz, K. F.; Kleist, W.; Grunwaldt, J.-D. (2017). Operando spectroscopy as atool to investigate the nature of Ni-based catalysts during dynamically operated menthanation of CO₂. 50. Jahrestreffen Deutscher Katalytiker, Weimar, March 15-17, 2017.
Oestreich, D.; Arnold, U.; Sauer, J. (2017). Synthesis of oxymethylene ethers (OME): An innovative and environmental friendly diesel fuel. 50. Jahrestreffen Deutscher Katalytiker, Weimar, March 15-17, 2017.
Oestreich, D. (2017). Fuels from Renewable Raw Materials : OME Synthesis and Properties. DGMK-Conference "Petrochemistry and Refining in a Changing Raw Materials Landscape", Dresden, Germany, 9th - 11th October 2017.
Schuler, J.; Hornung, U.; Kruse, A.; Sauer, J. (2017). Hydrothermal liquefaction of lignin. 5th International Conference on Medical Informatics & Telemedicine, Prague, CZ, August 29-30, 2017.
Schuler, J.; Hornung Ursel; Sauer, J. (2017). The challenge(s) of lignin as a chemical resource. 25th European Biomass Conference and Exhibition (2017), Stockholm, Sweden, June 12–15, 2017.
Sheppard, T. L.; Price, S. W. T.; Benzi, F.; Baier, S.; Klumpp, M.; Dittmeyer, R.; Schwieger, W.; Grunwaldt, J.-D. (2017). In situ multimodal X-ray tomography on a bifunctional core@shell catalyst for one-step DME synthesis. EuropaCat 2017, Florenz, I, August 27-31,2017.
Sprenger, P.; Kleist, W.; Fischer, A.; Grunwaldt, J.-D. (2017). Flame spray pyrolysis of multicomponent bismuth molybdate-based catalysts for the selective oxidation of propylene. 50. Jahrestreffen Deutscher Katalytiker, Weimar, 15.-17.März 2017.
Sprenger, P.; Stehle, M.; Gaur, A.; Gänzler, A. M.; Kleist, W.; Fischer, A.; Grunwaldt, J.-D. (2017). Challenging reactive behavior of bismuth molybdates during selective oxidation of propylene observed by combined operando Raman/XAS. EuropaCat 2017, Florenz, I, August 27-31,2017.
Stapf, D.; Dahmen, N.; Kolb, T.; Sauer, J. (2017). Bioenergy Research : Processes and Process Chains. China-Workshop „Energie“, Karlsruhe, Germany, 25th - 26th July 2017.
Steinbach, D.; Kruse, A.; Sauer, J. (2017). Conversion of lignocellulosic biomass to 5-hydroxymethylfurfural in water media. 2nd International Bioeconomy Congress, Stuttgart-Hohenheim, 12.-13. September 2017.
Stotz, H.; Maier, L.; Boubnov, A.; Gremminger, A.; Valchera, S.; Grunwaldt, J.-D.; Deutschmann, O. (2017). Methane oxidation over PdO: Surface reaction kinetics at fuel lean conditions. Jahrestreffen Reaktionstechnik, Würzburg, 22.-24.Mai 2017.
Stotz, H.; Maier, L.; Boubnov, A.; Gremminger, A.; Valchera, S.; Grunwaldt, J.-D.; Deutschmann, O. (2017). Surface reaction kinetics of methane oxidation over PdO. 25th 25th North American Catalysis Society Meeting (2017), Denver, CO, USA, June 4–9, 2017.
Studt, F. (2017, September 18). Applying Computational Catalysis to Advance Renewable Energy Solutions. 1st IMPRS – Recharge Scientific Symposium 2017 – Catalysis for Sustainable Chemical Energy Conversion (CSCEC 2018), Duisburg, Germany, September 17–21, 2018.
Studt, F. (2017, August 22). Density Functional Theory in Surface Science and Catalysis – Successes and Limitations. 53rd Symposium on Theoretical Chemistry - Big Data in Chemistry, Basel, Switzerland, 21. - 25. August 2017.
Studt, F. (2017, April 2). Mechanism of CO and CO2 Hydrogenation over Copper-Based Catalysts. 253rd ACS National Meeting & Exposition, San Francisco (USA), 2. - 6. April 2017.
Studt, F. (2017, March 23). Density Functional Theory in Surface Science and Catalysis – Successes and Limitations. DPG Frühjahrstagung der Sektion Kondensierte Materie - Fachverband Tiefe Temperaturen (SKM 2017), Dresden, Germany, March 19–24, 2017.
Studt, F. (2017, February 7). Theoretical Investigations of the Hydrogenation of CO and CO2 on Copper and Zinc Surfaces. Gordon Research Conference – Chemical Reactions at Surfaces, Lucca, Italy, February 5 - 10, 2017.
Weih, N.; Funke, A.; Ille, Y.; Pfitzer, C.; Niebel, A.; Dahmen, N. (2017). Online balancing of a pilot scale fast pyrolysis plant. 25th European Biomass Conference and Exhibition (2017), Stockholm, Sweden, June 12–15, 2017.
Wodarz, S.; Otto, T.; Zimmermann, M.; Sauer, J. (2017). Synthesis of gasoline-range hydrocarbons from dimethyl ether with hierarchical zeolite catalysts. Fuels - Conventional and Future Energy for Automobiles : 11th Colloquium, Stuttgart, 27.-29.Juni 2017.
Posters
Baehr, C.; Dahmen, N.; Gulden, J.; Raffelt, K. (2017, June 7). Enhancing the thermal stability of pyrolysis oil by carbon dioxide. 13th International conference on renewable resources and biorefineries (2017), Wrocław, Poland, June 7–9, 2017.
Cai, X.; Fink, V.; Bernard, R.; Stroh, A.; Wu, Y.; Marschall, H.; Deutschmann, O.; Frohnapfel, B.; Wörner, M. (2017). Phase-field Simulation of Droplet Wetting and Impact Phenomena. 2nd International Workshop on Near-Wall Reactive Flows, Darmstadt, Germany, 1st - 2nd June 2017.
Cai, X.; Wörner, M.; Marschall, H.; Deutschmann, O. (2017). CFD simulation of liquid back suction and gas bubble formation in connected tubes of different cross-section. 5th International Symposium on Modeling of Exhaust-Gas After-Treatment (MODEGAT-V), Bad Herrenalb, 3rd - 5th September 2017.
Carriel Schmitt, C.; Raffelt, K.; Rapp, M.; Dahmen, N. (2017). Hydrodeoxygenation of beech wood bio-oil over nickel catalyst. 2nd International Bioeconomy Congress, Stuttgart-Hohenheim, September 12-13, 2017.
Carriel-Schmitt, C.; Boscagli, C.; Raffelt, K.; Rapp, M.; Dahmen, N. (2017). Characterization of Light and Heavy Phase of Pyrolysis-Oil from Distinct Biomass for Further Upgrading Reactions. 25th European Biomass Conference and Exhibition (2017), Stockholm, Sweden, June 12–15, 2017.
Fan, Y.; Hornung, U.; Dahmen, N.; Kruse, A. (2017). Hydrothermal liquefaction of biomass: study of model compounds for the influence of Maillard reaction. 2nd International Bioeconomy Congress, Stuttgart-Hohenheim, 12.-13.09.2017.
Grandl, R.; Funke, A.; Dahmen, N.; Sauer, J. (2017). Characterisation of the twin screw mixing reactor used for fast pyrolysis of biomass. 25th European Biomass Conference and Exhibition (2017), Stockholm, Sweden, June 12–15, 2017.
Haltenort, P.; Oestreich, D.; Lautenschütz, L.; Arnold, U.; Sauer, J. (2017). Synthese von Oxymethylendimethylethern (OME) aus Dimethylether und Trioxan. Infotag Oxymethylenether, Frankfurt, 5. April 2017.
Ille, Y.; Sanchez, F.; Velez, A.; Pereda, S.; Dahmen, N.; Schaber, K. (2017). Vapor-Liquid Phase Equilibrium of Fast Pyrolysis Bio-Oils – Experiment and Modelling. 5th International Conference on Thermochemical Conversion Science (TcBiomass 2017), Chicago, IL, September 19-21, 2017.
Interrante, L.; Schiavo, B.; Scialdone, O.; Hornung, U.; Kruse, A.; Galia, A. (2017). Catalytic hydrothermal process for the conversion of stearic acid into hydrocarbons. 10th World Congress of Chemical Engineering (2017), Barcelona, Spain, October 1–5, 2017.
Lautenschütz, L.; Oestreich, D.; Haltenort, P.; Arnold, U.; Sauer, J. (2017). Catalytic Processes for the Production of Oxymethylene Ethers (OMEs). 25th 25th North American Catalysis Society Meeting (2017), Denver, CO, USA, June 4–9, 2017.
Oestreich, D.; Haltenort, P.; Arnold, U.; Sauer, J. (2017). Synthesis of oxymethylene ethers (OME) from methanol and formaldehyde. Infotag Oxymethylenether, Frankfurt, 5. April 2017.
Oestreich, D.; Lautenschütz, L.; Haltenort, P.; Hackbarth, K.; Arnold, U.; Sauer, J. (2017). Processes to Oxymethylene Dimethyl Ethers (OME) from Biobased Syngas. 5th International Conference on Thermochemical Conversion Science (TcBiomass 2017), Chicago, United States, 19th - 21st September 2017.
Schade, O. R.; Kalz, K. F.; Steinbach, D.; Kleist, W.; Grunwaldt, J.-D. (2017). Sustainable oxidation of biomass-derived 5-(Hydroxymethyl)furfural (HMF). 50. jahrestreffen Deutscher Katalytiker 2017, Weimar, 15.-17.03.2017.
Schuler, J.; Hornung, U.; Sauer, J. (2017). Hydrothermal liquefaction of lignin. 2nd International Bioeconomy Congress, Stuttgart-Hohenheim, 12.-13. September 2017.
Sheppard, T. L.; Benzi, F.; Doronkin, D. E.; Gänzler, A.; Grunwaldt, J.-D. (2017). Operando Turbo-XAS study of Pt-based diesel oxidation catalyst during rapid transient temperature driving cycles. EuropaCat 2017, Florenz, I, August 27-31,2017.
Tofighi, G.; Lichtenberg, H.; Sheppard, T.; Pesek, J.; Rinke, G.; Wang, W.; Schöttner, L.; Grunwaldt, J.-D. (2017). In situ XAS at the early stages of Au nanoparticle formation in a turbulent microflow. EuropaCat 2017, Florenz, I, August 27-31,2017.
Tofighi, G.; Gaur, A.; Doronkin, D. E.; Lichtenberg, H.; Wang, W.; Sheppard, T. L.; Rinke, G.; Grunwaldt, J.-D. (2017). Microfluidic synthesis of ultrasmall AuPd nanoalloys in continuous turbulent flow. 25th Annual Conference of the German Crystallographic Society (2017), Karlsruhe, Germany, March 27–30, 2017.
Tomasi Morgano, M.; Boscagli, C.; Funke, A.; Raffelt, K.; Leibold, H.; Stapf, D.; Dahmen, N. (2017). Production and Upgrading of Pyrolysis Oils Comparing Dast and Intermediate Pyrolysis. 5th International Conference on Thermochemical Biomass Conversion Science, TcBiomass 2017, Chicago, United States, 19th - 21st September 2017.
Wodarz, S.; Zimmermann, M. C.; Otto, T. N.; Pitter, S.; Hunger, M.; Sauer, J. (2017). Pore properties of desilicated H-ZSM-5 catalysts for conversion of dimethyl ether to gasoline. 29.Zeolith-Tagung, Frankfurt, 1.-3.März 2017.
Woo, M.; Wörner, M.; Maier, L.; Tischer, S.; Deutschmann, O. (2017). A Numerical Study on Gas-Liquid Taylor Flow for Catalytic Hydrogenation of Nitrobenzene with Detailed Kinetic Mechanism. Jahrestreffen der ProcessNet-Fachgruppen Mehrphasenströmungen, Partikelmesstechnik, Zerkleinern und Klassieren, Computational Fluid Dynamics, Mischvorgänge und dem TAK Aerosoltechnologie, Dresden, Deutschland, 14.-17.März 2017.
Zimina, A.; Dardenne, K.; Doronkin, D.; Lichtenberg, H.; Pruessmann, T.; Rothe, J.; Vitova, T.; Geckeis, H.; Grunwaldt, J. D. (2017). CAT-ACT - A highly versatile X-ray spectroscopy beamline for catalysis and radionuclide science at KIT. GeCatS Infoday "Synchrotron Radiation and Neutrons for Catalysis, Materials Research and Development", Frankfurt, 23.Oktober 2017.
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
PhD Theses
Cai, X. (2016). Interface-Resolving Simulations of Gas-Liquid Two-Phase Flows in Solid Structures of Different Wettability. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000065827
Lee, S. (2016). Novel bifunctional double-layer catalysts for application in microreactors for direct DME synthesis. PhD dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000052066
Master's Theses
Bernard, R. (2016, April 15). Phasenfeld Simulationen eines Tropfenaufpralls auf strukturierten Oberflächen. master’s thesis. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000079086
Jamshidi, F. (2016, July 15). CFD Simulation of an Air Bubble in Microfluidics using Volume of Fluid and Phase Field Methods in OpenFOAM. master’s thesis. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000078984
Journal Articles
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
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
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
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
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
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
Behrens, S.; Appel, I. (2016). Magnetic nanocomposites. Current opinion in biotechnology, 39, 89–96. doi:10.1016/j.copbio.2016.02.005
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
Breunig, M. (2016). Direct liquefaction of lignin and lignocellulose by catalytic hydrogenolysis. PyNe Newsletter, (39), 6–8.
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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.
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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, 6 (3), 347–354. doi:10.1007/s13399-015-0192-4
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
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
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
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
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
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
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
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
Conference Papers
Boukis, N.; Herbig, S.; Hauer, E.; Sauer, J.; Vogel, F. (2016). Catalytic gasification of digestate sludge in supercritical water : Experimental results on the pilot plant scale. 24th European Biomass Conference and Exhibition (EUBCE 2016), Amsterdam, Netherlands, 6th - 9th June 2016, 1062–1066, ETA.
Breunig, M.; Gebhard, P.; Hornung, U.; Dinjus, E. (2016). Direct liquefaction of lignin and lignin-rich biomass under conditions of former coal liquefaction. Beiträge zur DGMK-Fachbereichstagung "Konversion von Biomassen und Kohlen", Rotenburg an der Fulda, 9th - 11th May 2016, Deutsche Wissenschaftliche Gesellschaft für Erdöl, Erdgas und Kohle e.V. (DGMK).
Breuning, M.; Gebhart, P.; Hornung, U. (2016). Liquefaction of lignin and lignin-rich biomass by catalytic hydrogenolysis. 24th European Biomass Conference and Exhibition (EUBCE 2016), Amsterdam, Netherlands, June 6-9, 2016, ETA-Florence Renewable Energies.
Haltenort, P.; Lautenschütz, L.; Oestreich, D.; Arnold, U.; Sauer, J. (2016). Synthesis of oxymethylene dimethyl ethers (OMEs): soot reducing diesel additives from renewable resources. Kraftstoffe für die Mobilität von morgen : 2. Tagung der Fuels Joint Research Group, Bad Staffelstein, 1.-2.Juni 2016. Hrsg.: J. Krahl, 95–96, Cuvillier Verlag.
Mertens, F.; Nicoleit, T.; Raffelt, K. (2016). Comparison of Analytical Methods for Highly Aqueous Pyrolysis Condensates. Proceedings of the 24th European Biomass Conference and Exhibition : EUBCE 2016, Amsterdam, Netherlands, 6th - 9th June 2016, 1294–1297, ETA. doi:10.5071/24THEUBCE2016-3DV.3.49
Sauer, J.; Arnold, U.; Dahmen, N. (2016). Processes for Advanced Fuel Production from Biomass. Energie : Forschung und Perspektiven. Vorträge auf der DPG-Frühjahrstagung in Regensburg 2016. Hrsg.: H. Bruhns, 83–94, Deutsche Physikalische Gesellschaft (DPG).
Sauer, J.; Arnold, U.; Dahmen, N. (2016). Synthetic fuels from biomass: Potentials and viability. Internationaler Motorenkongress 2016.Mit Konferenz Nfz-Motorentechnologie Ed.: J. Liebl, 489–504, Springer Fachmedien Wiesbaden. doi:10.1007/978-3-658-12918-7_34
Schuler, J.; Hornung, U.; Kruse, A.; Sauer, J. (2016). Hydrothermal Liquefaction of Lignin. EUBCE 2016 : 24th European Biomass Conference and Exhibition, Amsterdam, Netherlands, 6-9 June 2016, 984–985, ETA. doi:10.5071/19thEUBCE2011-VP1.2.39
Reports/Preprints
Boukis, N.; Herbig, S.; Hauer, E. (2016). Gasification of Dutch sewage sludge in supercritical water : commissioned by STOWA / NL STOWA Project number DQL 432.601 ; Final Report. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000051638
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. (2016). Exhaust gas catalysts in action; operando HERFD-XAS and XES for elucidating the mechanism of NOₓ-removal by ammonia SCR.
Presentations
Appel, I.; Sebastian, N.; Eremin Alexey; Stannarius, R.; Behrens, S. (2016). Stable suspensions of mesogen-hybridized magnetic nanoparticles in thermotropic liquid crystals. 14th International Conference on Magnetic Fluids (ICMF 14), Ekaterinburg, Russia, July 4-8, 2016.
Arnold, U.; Sauer, J.; Burger, J.; Hasse, H.; Härtl, M.; Wachtmeister, G. (2016). Oxymethylene dimethyl ethers (OMEs): Alternative Diesel fuels for low-emission combustion. ProcessNet-Jahrestagung und 32. DECHEMA-Jahrestagung der Biotechnologen (2016), Aachen, Germany, September 12–15, 2016.
Becker, G.; Funke, A.; Anton, N.; Wunderlich, M.; Kruse, A. (2016). Phosphat-Fraktionierung nach SMT-Protokoll – Anwendungsfall Klärschlamm und dessen Karbonisate aus HTC und Pyrolyse. Hydrothermale Prozesse - Technologien zur stofflichen und energetischen Wertschöpfung, Leipzig, 8.-9.September 2016.
Behrens, S.; Appel, I. (2016). Synthesis and properties of functional magnetic hybrid materials. EMN Prague Meeting : Energy Materials Nanotechnology, Praha, CZ, June 21-24, 2016.
Boscagli, C.; Raffelt, K.; Grunwaldt, J.-D. (2016). Study of the reactivity of platform molecules in aqueous solution and in the pyrolysis oil during hydrotreatment. 21st International Symposium on Analytical and Applied Pyrolysis, Nancy, F, May 9-12, 2016.
Boukis, N.; Herbig, S.; Hauer, E.; Sauer, J.; Vogel, F. (2016). Catalytic gasification of digestate sludge in supercritical water. Experimental results on the pilot plant scale. 24th European Biomass Conference and Exhibition (EUBCE 2016), Amsterdam, NL, June 6-9, 2016.
Breunig, M.; Gebhard, P.; Hornung U.; Dinjus, E. (2016). Direct liquefaction of lignin and lignin-rich biomass under conditions of former coal liquefaction. DGMK Fachbereichstagung Konversion von Biomassen und Kohlen, Rotenburg a.d. Fulda, 9.-11.Mai 2016.
Breunig, M.; Gebhart, P.; Hornung, U.; Kruse, A. (2016). Liquefaction of lignin by catalytic hydrogenolysis. ECO-BIO 2016, Rotterdam, NL, March 6-9, 2016.
Cai, X.; Wörner, M.; Deutschmann, O. (2016). Direct Numerical Simulations for Interface-resolving of Gas-liquid Flows in Solid Sponge Structure. 9th International Conference on Multiphase Flow (ICMF 2016), Firence, I, May 22-27, 2016.
Cai, X.; Wörner, M.; Marschall, H.; Deutschmann, O. (2016, June 23). Numerical study on the wettability dependent interaction of a rising bubble with a periodic open cellular structure. 5th International Conference on Structural Catalysts and Reactors (ICOSCAR-3 2016), San Sebastian, Spain, June 22–24, 2016.
Cai, X.; Wörner, M.; Marschall, H.; Deutschmann, O. (2016). Direct Numerical Simulations of Gas-liquid Flows in Subdomains of Structured Innovative Multiphase Chemical reactors. Jahrestreffen der ProcessNet-Fachgruppen Agglomerations- und Schüttguttechnik, Mehrphasenströmungen und Computational Fluid Dynamics, Bingen, 29. Februar - 2. März 2016.
Dahmen, N.; Funke, A.; Pfitzer, C.; Raffelt, K.; Tröger, N.; Weirich, F.; Sauer, J. (2016). Fast pyrolysis within the bioliq process. DGMK Fachbereichstagung Konversion von Biomassen und Kohlen, Rotenburg a.d. Fulda, 9.-11.Mai 2016.
Dahmen, N. (2016). Systems analysis of the bioliq process as a thermochemical biorefinery. 12th International Conference on Renewable Resources and Biorefineries, Gent, B, May 30 - June 1, 2016.
Dahmen, N. (2016). Technologien der Biomasseverflüssigung. FNR Fachgespräch ’Einsatzmöglichkeiten von Bioölen als Brenn- und Kraftstoff’, Berlin, 18.-19.Fenruar 2016.
Dahmen, N.; Hornung, U. (2016). Introduction to the bioliq process. IBN-Forum ’Sustainable Biorefinery Processes for Creating Added Value from Lignocellulosic Biomass’, Hamburg, 2.November 2016.
Dahmen, N.; Neumann, A. (2016). Biosyngas production and its advanced chemical and biochemical use - syngas production. UFZ Energy Days 2016, Leipzig, March 22-23, 2016.
Dallmann, F. (2016). Neue Perspektiven der Biomasseverflüssigung. Jahrestreffen Reaktionstechnik 2016 zusammen mit der ProcessNet-Fachgruppe Mischvorgänge, Würzburg, 2.-4.Mai 2016.
Dallmann, F.; Boeltken, T.; Pfeifer, P.; Cavusoglu, G.; Kot, A.; Yu, J.; Zhang, Z.; Bram, M.; Goldbach, A.; Dittmeyer, R. (2016). Ultra-compact micro sturctured membrane reactor for production of pure hydrogen. Jahrestreffen Reaktionstechnik 2016 zusammen mit der ProcessNet-Fachgruppe Mischvorgänge, Würzburg, 2.-4.Mai 2016.
Eberhard, M.; Raffelt, K.; Sauer, J.; Kolb, T. (2016). FT2.3 Verlinkung entlang der Prozesskette "Thermochemische Biomasse-Konversion". ES2050 Workshop FT2 Biogene Energieträger, Frankfurt a. Main, 16.09.2016.
Funke, A. (2016). Carbonization of biomass in Germany - Technology and products. Deutsch-Chinesisches Symposium "Biochar for Sustainable Agriculture: Opportunity and Challenge”, Shenyang, China, June 13-17, 2016.
Funke, A.; Grandl, R.; Dahmen, N.; Sauer, J. (2016). Heat transfer between solid particles: Application to fast pyrolysis. 21st International Symposium on Analytical and Applied Pyrolysis, Nancy, F, May 9-12, 2016.
Funke, A. (2016). Biomass Pyrolysis in Germany - Political Background, Technology and Products. Visit of King Mongkut’s Institute of Technology Lad Krabang, Bangkok, T, October 26, 2016.
Funke, A. (2016). Weiterentwicklung der Schnellpyrolyse am IKFT. Visit of Tongji University, Shanghai, China, July 4-12, 2016.
Grunwaldt, J.-D. (2016). Understanding catalysts under dynamic reaction conditions: A rising challenge in heterogeneous catalysis. GDCh-Kolloquium, München, 29.November 2016.
Grunwaldt, J.-D. (2016). Advanced characterization tools for elucidating structural dynamics of nanostructured catalysts. Post-Symposium of the 16th International Congress on Catalysis (ICC 16), Dalian, China, July 9-11, 2016.
Grunwaldt, J.-D. (2016). Dynamics and reactivity of catalysts in exhaust gas aftertreatment: Operando, time-resolved and spatially resolved spectroscopy. 16th International Congress on Catalysis (ICC 16), Beijing, China, July 3-8, 2016.
Guo, B.; Hornung, U.; Frey, W.; Dahmen, N. (2016). Biorefinery of microalgae by means of hydrothermal liquefaction. Verbundtreffen Mikroalgen, Universität Hohenheim, 26.Februar 2016.
Hornung, U.; Breunig, M. (2016). Lignin und Biomasse Verflüssigung nach dem Vorbild der Kohleverflüssigung. Nachhaltige Strategien für die Energie- und Ressourcenwende : Sommersymposium Fraunhofer UMSICHT, Sulzbach-Rosenberg, 29.Juli 2016.
Hornung, U. (2016). Strategies for lignin liquefaction. IBN-Forum ’Sustainable Biorefinery Processes for Creating Added Value from Lignocellulosic Biomass’, Hamburg, 2.November 2016.
Ille, Y.; Dahmen, N.; Schaber, K. (2016). Experimentelle Untersuchung der Aktivität von Wasser in Pyrolyseölen. Thermodynamik Kolloquium, Kaiserslautern, 5.-7.Oktober 2016.
Kleist, W. (2016). Metal-organic frameworks based on STA-12 and STA-16 as single-site catalyst materials for applications in fine chemistry. Chemiedozententagung, Heidelberg, 21.-23.März 2016.
Lopez Barreiro, D.; Hornung, U.; Kruse, A.; Ronsse, F.; Prins, W. (2016). Biorefinery of microalgae vie HTL. A techno-economic assessment. 15th European Meeting on Supercritical Fluids (EMSF 2016), Essen, May 8-11, 2016.
Lopez Barreiro, D.; Ronsse, F.; Hornung, U.; Kruse, A.; Prins, W. (2016). Hydrothermal liquefaction of microalgae and subsequent heterogeneous catalytic upgrading of biocrude oil. Symposium on Hydrotreatment for the Processing of Renewable Oils (HyPro), Gent, B, February 25, 2016.
Neves, R. C.; Funke, A.; Gomez, E. O.; Filho, R. M.; Bonomi, A.; Dahmen, N. (2016). Process simulation of fast pyrolysis to produce bioslurry from lignocellulosic biomass residues combining first and second generation ethanol and biofuel biorefinery. 6th International Symposium on Energy from Biomass and Waste, Venezia, I, November 14-17, 2016.
Paris, K.; Martel, J.; Ungerer, M. (2016). Micro glass processing. Hot processing of glass tubes under a microscope. 61st Annual Symposium of the American Scientific Glassblowers Society, Tucson, AZ, May 17-20, 2016.
Posom, J.; Sirisomboon, P.; Funke, A.; Heinrich, J.; Maier, J.; Griesheimer, P. (2016). Feasibility of evaluation of pyrolysis characteristic of bamboo chips using of near infrared spectroscopy. 5th Asian NIR Symposium, Kagoshima, J, November 30 - December 3, 2016.
Posom, J.; Sirisomboon, P.; Funke, A.; Heinrich, J.; Maier, J.; Griesheimer, P. (2016). Near infrared spectroscopy as an alternative method to thermogravimetric analysis for evaluation of volatile matter of bamboo wood chips. 9th Thai Society of Agricultural Engineering International Conference, Bangkok, T, September 8-10, 2016.
Rischard, J.; Antinori, C.; Maier, L.; Deutschmann, O. (2016). Oxidative dehydrogenation of n-butane and butenes to 1,3-butadiene over Mo-V and Mo-Bi based catalysts in a tow-zone fluidized bed reactor. 24th International Symposium on Chemical Reaction Engineering, Minneapolis, MN, USA, June 12-15, 2016.
Rischard, J.; Antinori, C.; Maier, L.; Deutschmann, O. (2016). Direct 1,3-butediene production out of n-butane and butenes in a two-zone fluidized bed reactor with MO based catalysts. 11th Natural Gas Conversion Symposium, Tromso, N, June 5-9, 2016.
Sauer, J. (2016). Routes from methanol to OMEs. State of the art and future potentials. 3rd Methanol Technology and Policy Commercial Congress (MTPCC), Frankfurt, November 29 - December 1, 2016.
Sauer, J.; Arnold, U.; Dahmen, N. (2016). Processes for Advanced Fuel Production from Biomass. 80. Jahrestagung der DPG und DPG-Frühjahrstagung der Sektion Kondensierte Materie, Regensburg, 6.-11.März 2016.
Sauer, J.; Arnold, U.; Dahmen, N. (2016). Synthetic fuels from biomass: Potentials and viability. 3.Internationaler Motorenkongress, Baden-Baden, 23.-24.Februar 2016.
Schmitt, C. C.; Rapp, M.; Voigt, A.; Dahmen, N. (2016). Surface Acoustic Wave (SAW) sensor system for low cost gas analysis and characterization of biofuels. 3rd World Congress of the Digital Olfaction Society (DOS), Tokyo, J, December 7-8, 2016.
Schmitt, C. C.; Rapp, M.; Voigt, A.; Dahmen, N. (2016). Detection of durene content in biofuels using a surface acoustic wave (SAW) sensor array. SAW Symposium and DKE Workshop 2016, Dresden, October 19-21, 2016.
Schmitt, C. C.; Rapp, M.; Voigt, A.; Dahmen, N. (2016). Detection of Aromatic Compounds in Artificial Gasoline with Hybrid Surface Acoustic Wave Sensor array and a short packed column (SAW-GC). IEEE Sensors 2016, Orlando, FL, October 30 - November 2, 2016.
Schuler, J.; Hornung, U.; Kruse, A.; Sauer, J. (2016). Hydrothermal liquefaction of lignin. 24th European Biomass Conference and Exhibition (EUBCE 2016), Amsterdam, NL, June 6-9, 2016.
Siebert, M.; Zimmermann, R. R.; Armbruster, M.; Dittmeyer, R. (2016). Novel intermetallic catalyst wall coatings in micro-channels for the selective hydrogenation of acetylene. 3rd Indo-German Workshop on the Advances in Materials, Reaction and Separation Processes, Guwahati, IND, February 23-26, 2016.
Trunk, R.; Henn, T.; Nirschl, H.; Krause, M. (2016). Inertial Dilute Particulate Fluid Flow Simulations with an Euler-Euler Lattice Boltzmann Method for Cross Flow Filtration. Jahrestreffen der ProcessNet-Fachgruppen Agglomerations- und Schüttguttechnik, Mehrphasenströmungen und Computational Fluid Dynamics, Bingen, 29. Februar - 2. März 2016.
Wodarz, S.; Zimmermann, M.; Otto, T. N.; Sauer, J. (2016). Conversion of dimethyl ether into gasoline-like hydrocarbons over hierarchical H-ZSM-5 catalysts. 2nd Workshop ’Hierarchically-ordered Materials - from Theory to Applications’, Erlangen, September 27-29, 2016.
Wörner, M.; Cai, X.; Marschall, H.; Deutschmann, O. (2016). Numerical study on the wettability dependent interaction of droplets and bubbles with solid structures. 9th International Conference on Multiphase Flow (ICMF 2016), Firence, I, May 22-27, 2016.
Zimmerlin, B.; Eberhard, M.; Fridbjarnarson, G.; Galla, U.; Kolb, T.; Mai, R.; Michelfelder, B.; Niebel, A.; Weirich, F.; Willy, M. (2016). Status Quo of the bioliq®-process at KIT. 9th International Seminar on Gasification, 19.-20. Oktober 2016, Malmö, Schweden.
Posters
Becker, G. C.; Funke, A.; Anton, N.; Wunderlich, M.; Kruse, A. (2016). Phosphat-Fraktionierung nach SMT-Protokoll. Klärschlamm und dessen Karbonisate aus HTC und Pyrolyse. Smart Bioenergy – Wie sieht die Zukunft der Bioenergie aus? : DBFZ Jahrestagung, Leipzig, 8.-9.September 2016.
Dallmann, F.; Cavusoglu, G.; Gietzelt, T.; Pfeifer, P.; Lichtenberg, H.; Grunwaldt, J. D.; Dittmeyer, J. D. (2016). Ultra-compact micro structured Membrane reactor for spatial-resolved in-operando XAS measurements. Jahrestreffen der ProcessNet-Fachgruppen Hochdruckverfahrenstechnik, Mikroverfahrenstechnik, Molekulare Modellierung und Simulation (MIKRO) (2017), Frankfurt am Main, Germany, March 8–10, 2017.
Funke, A.; Tomasi Morgano, M.; Dahmen, N.; Leibold, H. (2016). Experimental comparison of fast and intermediate pyrolysis at pilot scale. 21st International Symposium on Analytical and Applied Pyrolysis, Nancy, F, May 9-12, 2016.
Grandl, R.; Funke, A.; Dahmen, N.; Sauer, J. (2016). Fast pyrolysis of biomass using a twin screw mixing reactor: Simulation of the mixing behavior for characterisation of the mass- and energy transport under respect to the insertion order. DGMK Fachbereichstagung Konversion von Biomassen und Kohlen, Rothenburg a.d. Fulda, 9.-11.Mai 2016.
Grandl, R.; Funke, A.; Dahmen, N.; Sauer, J. (2016). Fast pyrolysis of biomass using a twin screw reactor: Simulation of the mixing behavior for characterisation of the mass- and energy transport. Jahrestreffen Reaktionstechnik 2016 zusammen mit der ProcessNet-Fachgruppe Mischvorgänge, Würzburg, 2.-4.Mai 2016.
Grandl, R.; Funke, A.; Dahmen, N.; Sauer, J. (2016). Fast pyrolysis of biomass using a twin screw mixing reactor: Simulation of the mixing behavior of different geometries for optimization of the mass- and energy transport. Thermochemical Lignocellulose Conversion Technologies : Cascatbel Workshop 2016, Porto Carras, GR, May 18-20, 2016.
Haltenort, P.; Lautenschütz, L.; Oestreich, D.; Arnold, U.; Sauer, J. (2016). Synthesis of oxymethylene dimethyl ethers (OMEs): soot reducing diesel additives from renewable resources. 2.Tagung der Fuels Joint Research Group, Bad Staffelstein, 1.-2.Juni 2016.
Herbig, S.; Lam, H.; Boukis, N.; Sauer, J. (2016). Fermentation von Synthesegas unter hohem Druck. 5. Jahrestagung des KIT-Zentrums Energie, Blick nach Vorne - Energiesystem 2050, Karlsruhe, 15.Juni 2016.
Hettel, M.; Antinori, C.; Deutschmann, O. (2016). Numerical simulation of a structured catalytic methane reformer by DUO, the Coupling of OpenFOAM and DETCHEM. 5th International Conference on Structural Catalysts and Reactors (ICOSCAR-3 2016), San Sebastian, Spain, June 22–24, 2016.
Hettel, M.; Antinori, C.; Deutschmann, O. (2016). CFD simulation of a structured catalytic methane reformer including detailed chemistry. 11th Natural Gas Conversion Symposium, Tromso, N, June 5-9, 2016.
Ille, Y.; Hamberger, P.; Dahmen, N.; Schaber, K. (2016). Wärme- und Stofftransport während der Kondensation von Schnellpyrolysedämpfen. ProcessNet-Jahrestagung und 32. DECHEMA-Jahrestagung der Biotechnologen (2016), Aachen, Germany, September 12–15, 2016.
Ille, Y.; Hamberger, P.; Dahmen, N.; Schaber, K. (2016). Aerosol formation during the condensation of fast pyrolysis vapours. 22nd European Aerosol Conference (EAC 2016), Tours, France, September 4–9, 2016.
Kalz, K. F.; Hengst, K.; Thrane, J.; Kleist, W.; Grunwaldt, J.-D. (2016). Towards a sustainable process for the synthesis of γ-valeroactone. Jahrestagung der Fachgruppe Nachhaltige Chemie der GDCh, Karlsruhe, 19.-21.September 2016.
Latif, S.; Funke, A.; Müller, J. (2016). Pyrolysis of cassava peel in a fluidized bed reactor. 12th International Conference on Renewable Resources and Biorefineries, Ghent, B, May 30 - June 1, 2016.
May, K.; Appel, I.; Behrens, S.; Eremin, A.; Stannarius, R. (2016). Magneto-optical properties of colloidal mixtures of anisometric non-magnetic pigment particles and isometric magnetic nanoparticles. 14th International Conference on Magnetic Fluids (ICMF 14), Ekaterinburg, Russia, July 4-8, 2016.
Mutz, B.; Carvalho, H. W. P.; Kleist, W.; Grunwaldt, J. D. (2016). Methanation of CO₂: Structural response of a Ni-based catalyst under dynamic reaction conditions unraveled by operando spectroscopy. 3rd International Conference on Renewable Energy Gas Technology (REGATEC 2016), Malmö, S, May 10-11, 2016.
Mutz, B.; Carvalho, H. W. P.; Kleist, W.; Grunwaldt, J. D. (2016). Methanation of CO₂ under dynamic reaction atmospheres using supported Ni catalysts. 16th International Congress on Catalysis (ICC 16), Beijing, China, July 3-8, 2016.
Mutz, B.; Carvalho, H. W. P.; Kleist, W.; Grunwaldt, J.-D. (2016). Structural changes of Ni-based catalysts during dynamic methanation of CO₂ for power to gas applications. 49.Jahrestreffen Deutscher Katalytiker, Weimar, 16.-18.März 2016.
Oestreich, D.; Arnold, U.; Lautenschütz, L.; Herrera Delgado, K.; Sauer, J. (2016). Processes for the production of oxygenate fuels from renewables. 24th International Symposium on Chemical Reaction Engineering, Minneapolis, MN, June 12-15, 2016.
Oestreich, D.; Arnold, U.; Sauer, J. (2016). Synthesis of oxymethylene dimethyl ethers (OME) as alternative diesel fuels. Jahrestreffen Reaktionstechnik 2016 zusammen mit der ProcessNet-Fachgruppe Mischvorgänge, Würzburg, 2.-4.Mai 2016.
Oestreich, D.; Lautenschütz, L.; Arnold, U.; Sauer, J. (2016). Catalytic pathways for the synthesis of oxygenate fuels. 16th International Congress on Catalysis, Beijing, China, July 3-8, 2016.
Otto, T. N.; Wodarz, S.; Zimmermann, M.; Dinjus, E.; Sauer, J. (2016). Effect of desilication on synthesis of hierarchical H-ZSM-5 zeolites. 28.Deutsche Zeolith-Tagung, Gießen, 2.-4.März 2016.
Otto, T. N.; Wodarz, S.; Zimmermann, M.; Dinjus, E.; Sauer, J. (2016). Gasoline-like hydrocarbons using hierarchical H-ZSM-5. 28.Deutsche Zeolith-Tagung, Gießen, 2.-4.März 2016.
Schade, O. R.; Kalz, K. F.; Kleist, W.; Grunwaldt, J.-D. (2016). Sustainable production of 2,5-furandicarboxyclic acid for bio-based polymers. Jahrestagung der Fachgruppe Nachhaltige Chemie der GDCh, Karlsruhe, 19.-21.September 2016.
Schuler, J.; Hornung, U.; Sauer, J. (2016). Hydrothermal lignin liquefaction. 2nd Status Seminar and Interim Evaluation of the Bioeconomy Research Programme Baden-Württemberg, Stuttgart, October 13, 2016.
Schuler, J.; Hornung, U.; Sauer, J. (2016). Hydrothermal lignin liquefaction. ECO-BIO 2016, Rotterdam, NL, March 6-9, 2016.
Sprenger, P.; Kleist, W.; Fischer, A.; Grunwaldt, J.-D. (2016). Hydrothermal synthesis of Bi-Mo-Co-Fe-oxides for the selective oxidation of propylene. 49.Jahrestreffen Deutscher Katalytiker, Weimar, 16.-18.März 2016.
Steinbach, D.; Breunig, M.; Kruse, A.; Wild, S.; Zanker, M. (2016). Isomerization of glucose to fructose for the production of 5-hydroxymethylfurfural from lignocellulosic biomass. ECO-BIO 2016, Rotterdam, NL, March 6-9, 2016.
Walter, K., M.; Kalz, K. F.; Kleist, W.; Grunwaldt, J.-D. (2016). Catalytic synthesis of higher alcohols from synthesis gas and ethanol. 49.Jahrestreffen Deutscher Katalytiker, Weimar, 16.-18.März 2016.
Wodarz, S.; Zimmermann, M.; Otto, T. N.; Sauer, J. (2016). Conversion of dimethyl ether into gasoline-like hydrocarbons over hierarchical zeolite catalysts. Jahrestreffen Reaktionstechnik 2016 zusammen mit der ProcessNet-Fachgruppe Mischvorgänge, Würzburg, 2.-4.Mai 2016.
Woo, M.; Wörner, M.; Tischer, S.; Deutschmann, O. (2016). Mass transfer and catalytic reaction in Taylor flow: parametric numerical study for frozen hydrodynamics. 5th International Conference on Structural Catalysts and Reactors (ICOSCAR-3 2016), San Sebastian, Spain, June 22–24, 2016.
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
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
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
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
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
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
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
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
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
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
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
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
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.
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
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
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
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
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
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
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.
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
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Kruse, A.; Grandl, R. (2015). Hydrothermale Karbonisierung: 3. Kinetisches Modell. Chemie - Ingenieur - Technik, 87 (4), 449–456. doi:10.1002/cite.201400116
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
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
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
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
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
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
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
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
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
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
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
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
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
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
Sauer, J.; Klemm, E. (2015). New Tasks for the Reaction Technique. Chemie - Ingenieur - Technik, 87 (6), 667–667. doi:10.1002/cite.201590035
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
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
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
Schwiderski, M.; Kruse, A. (2015). Aluminiumchlorid-katalysierter Organosolv-Aufschluss von Buchenholz. Chemie - Ingenieur - Technik, 87, 922–830. doi:10.1002/cite.201400096
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
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
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
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
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
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
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
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
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
Conference Papers
Arnold, U.; Lautenschütz, L.; Oestreich, D.; Sauer, J. (2015). Production of Oxygenate Fuels from Biomass-Derived Synthesis Gas. Preprints of the DGMK-Conference : Synthesis Gas Chemistry. Dresden, October 7-9, 2015. Ed.: S. Ernst, 127–136, Deutsche Wissenschaftliche Gesellschaft für Erdöl, Erdgas und Kohle e.V. (DGMK).
Boukis, N.; Korving, L.; Hauer, E.; Herbig, S.; Sauer, J. (2015). Gasification of sewage sluge in supercritical water, experimental results from the gasification of Dutch sewage sludge. 23rd European Biomass Conference and Exhibition, Vienna, Austria, 1-4 June 2015, 83–87, Vienna. doi:10.5071/23rdEUBCE2015-1CO.5.2
Hornung, U.; Kruse, A. (2015). Comparison of thermal and hydrothermal lignin degradation. Reactions mechanisms and a strategy for lignin recovery. 23rd European Biomass Conference and Exhibition (EUBCE 2015), Wien, A, June 1-4, 2015 Proceedings publ.online Firenze : ETA-Florence Renewable Energies, 2015.
Nicoleit, T.; Pählke, O.; Shrestha, G.; Struwe, K. D.; Sauer, J. (2015). Stability of pyrolysis char suspensions. Proceedings of the 23rd European Biomass Conference and Exhibition (EUBCE 2015), Wien, A, June 1-4, 1216–1222, ETA-Florence Renewable Energies.
Sauer, J.; Arnold, U.; Dahmen, N.; Henrich, E. (2015). Synthetic Biofuels from Lignocellulosic Biomass, Recent Activities in Europe and Germany. Fuels : Conventional and Future Energy for Automobiles. 10th International Colloquium, Ostfildern, January 20-22, 2015. Ed.: W.J. Bartz, 419–442, Technische Akademie Esslingen (TAE).
Sauer, J. (2015). Syngas as Platform from Sustainable Feedstocks to Fuels. Energy, Science and Technology 2015. The energy conference for scientists and researchers. Book of Abstracts, EST, Energy Science Technology, International Conference & Exhibition, 20-22 May 2015, Karlsruhe, Germany, 36, Karlsruher Institut für Technologie (KIT).