Publikationen

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 

Bernart, S. (2025, Januar 9). First Principle Investigations of the Activity of Pd and Pt Noble Metals in Varying Sizes Supported on Ceria. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000175624  

Chen, J. (2025, März 12). Structure and Composition of PtPd Model Catalysts under Operando Conditions. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000179829  

Das, S. (2025, Mai 16). Multidimensional Morphological and Chemical Analysis of Heterogeneous Catalytic Systems using Hard X-ray Microscopy. 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. Dissertation. Karlsruher Institut für Technologie (KIT). 

Kramarenko, A. S. (2025, März 25). Multi-Scale Modelling of Electrode-Electrolyte Interface: A Case Study on the Electrochemical Carboxylation of Benzyl Chloride. 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. Dissertation. Karlsruher Institut für Technologie (KIT). 

Perret, L. (2025, Januar 14). Experimental analysis of the influence of key process parameters on synthesis gas fermentation in continuous operation with Clostridium ljungdahlii. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000177709  

Schmitt, C. (2025, April 24). Kontinuierliche Nanopartikelsynthese mit enger Partikelgrößenverteilung für katalytische Anwendungen. Dissertation. Karlsruher Institut für Technologie (KIT). 

Treu, P. (2025, Februar 6). Towards the oxidative cleavage of unsaturated fatty acids using zeolite catalysts. Dissertation. Karlsruher Institut für Technologie (KIT). 

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 (CO) (PPh ] Clusters: Mechanism and Energetics in Gas Phase and on an Inert Surface. ACS Nano, 19 (3), 3624–3634. doi:10.1021/acsnano.4c13954 

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  

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 

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 

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. 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  

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 and its Influence on the Performance in CO‐to‐Methanol Synthesis. European Journal of Inorganic Chemistry, 28 (4), e202400684. doi:10.1002/ejic.202400684 

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 Catalyst during CO‐to‐Methanol Synthesis at High Conversions by Operando Spectroscopy. Angewandte Chemie International Edition, 64 (15). doi:10.1002/anie.202423281  

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  

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  

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 

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 

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  

Jordt, P. (2025). Supplementary Information for Publication: Specifications for Electronic Laboratory Notebooks (ELN) in the Photon and Neutron Community. Zenodo. doi:10.5281/zenodo.13891464  

Wang, B.; Da Roit, N.; Schild, D.; Zimmermann, M.; Wang, Y.; Yu, Z.; Chen, S.; Behrens, S. (2025, Februar 13). Research data to "Single-Step Synthesis of Dimethyl Ether from Syngas over Nanoparticle-Derived Bifunctional Pd/CeO2/Al2O3 Catalysts". doi:10.35097/4jh897ny0tvjsa2e 

Düll, A.; Lehmann, J.; Börnhorst, M.; Ates, C.; Häber, T.; Deutschmann, O. (2025, Februar 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 

Huynh, T.-N. (2025). MLFF-TI Oxygenates on Pt. doi:10.35097/9srq4sv6cg1a0w3h 

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, Februar 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 

Sireci, E.; Studt, F. (2025, April 16). Modeling the Shape and Stability of Co Nanoparticles as a Function of Size and Support Interactions through DFT Calculations and Monte Carlo Simulations: SI. doi:10.35097/rn0ygj9jwa7ggh91 

Struzek, S.; Delrieux, T.; Maurer, F.; Gonçalves, D. S.; Heck, S. L.; Klag, L.; Czechowsky, J.; Zimina, A.; Grunwaldt, J.-D. (2025, März 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, März 24). Role of powders and coatings for relating catalytic activity and structure of Pt in emission control catalysis - Raw data. doi:10.35097/urp37a5c07yzeeds 

Eichner, F. (2024, April 29). Untersuchungen zur oxidativen Dehydrierung von Methanol zu Formaldehyd - Betrachtungen auf Katalysator- und Prozessebene. 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. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000173473  

Huber, P. (2024, März 11). Dehydration and Decarboxylation Reactions in Brønsted and Lewis Acidic Zeolites. 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. Dissertation. Karlsruher Institut für Technologie (KIT). 

Robazza, A. (2024, August 12). Hybrid thermochemical-biological processes to enhance the energy recovery from waste. 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. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000165194  

Spiske, L. F. (2024, März 19). Theoretical investigation of n-butane isomerization in metal-substituted aluminosilicates. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000168927  

Trinkies, L. L. G. (2024, Juli 17). Untersuchungen zur Direktsynthese von Wasserstoffperoxid in mikrostrukturierten Membranreaktoren. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000169011  

Wild, S. (2024, Mai 27). Untersuchung der Kinetik der einstufigen DME-Synthese unter variablem CO/CO2 Synthesegas für Scale-Up und Prozess-Optimierung. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000170570  

Zimmermann, J. V. (2024, Juli 1). Optimization of the biocrude nitrogen content during the hydrothermal fractionation of municipal sewage sludge including pre- and post-treatments. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000172120  

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 as an Additive. Energy & Fuels, 38 (7), 6012–6019. doi:10.1021/acs.energyfuels.3c04201  

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  

Braun, L.; Spielmann, J.; Doronkin, D. E.; Kuhn, C.; Maliugin, A.; Sharapa, D. I.; Huck, I.; Bao, J.; Tischer, S.; Studt, F.; Deutschmann, O.; Kramm, U. I.; Grunwaldt, J.-D. (2024). Following the Structural Changes of Iron Oxides during Reduction under Transient Conditions. ChemSusChem, 17 (24), Art.-Nr.: e202401045. doi:10.1002/cssc.202401045 

Bruder, J.; Fischer, K.; Armleder, J.; Müller, E.; Da Roit, N.; Behrens, S.; Peng, Y.; Wenzel, W.; Röhm, H.; Colsmann, A. (2024). Photocatalytic Hydrogen Generation in Surfactant‐Free, Aqueous Organic Nanoparticle Dispersions. Small, 20 (47), 2406236. doi:10.1002/smll.202406236  

Canabarro, N. I.; Yeadon, D. J.; Wörner, M.; Hornung, U.; Vogel, F.; Baudouin, D. (2024). Development of strategies for continuous desalination of weak black liquor based on phase-behaviour analysis. The Journal of Supercritical Fluids, 209, Art.-Nr.: 106230. doi:10.1016/j.supflu.2024.106230  

Chacko, R.; Goßler, H.; Angeli, S.; Deutschmann, O. (2024). Interconnected Digital Solutions to Accelerate Modeling of the Reaction Kinetics in Catalysis. ChemCatChem, 16 (4), Art.-Nr.: e202301355. doi:10.1002/cctc.202301355  

Chawla, J.; Schardt, S.; Lott, P.; Angeli, S.; Tischer, S.; Maier, L.; Deutschmann, O. (2024). Detailed kinetic modeling of catalytic oxidative coupling of methane. Chemical Engineering Journal, 482, Art-Nr.: 148719. doi:10.1016/j.cej.2024.148719  

Chen, J.; Sharapa, D. I.; Plessow, P. N. (2024). Stability of Hydroxylated α-FeO(0001) Surfaces. ACS Omega, 9 (33), 35449–35457. doi:10.1021/acsomega.4c02113  

Chen, S.; Jelic, J.; Rein, D.; Najafishirtari, S.; Schmidt, F.-P.; Girgsdies, F.; Kang, L.; Wandzilak, A.; Rabe, A.; Doronkin, D. E.; Wang, J.; Friedel Ortega, K.; DeBeer, S.; Grunwaldt, J.-D.; Schlögl, R.; Lunkenbein, T.; Studt, F.; Behrens, M. (2024). Highly loaded bimetallic iron-cobalt catalysts for hydrogen release from ammonia. Nature Communications, 15 (1), Art.-Nr.: 871. doi:10.1038/s41467-023-44661-6  

Chen, S.; Pleßow, P. N.; Yu, Z.; Sauter, E.; Caulfield, L.; Nefedov, A.; Studt, F.; Wang, Y.; Wöll, C. (2024). Structure and Chemical Reactivity of Y‐Stabilized ZrO 2 Surfaces: Importance for the Water‐Gas Shift Reaction. Angewandte Chemie - International Edition, 63 (27), e202404775. doi:10.1002/anie.202404775  

Chowdhury, A. G.; Arnold, U.; Garbev, K.; Bender, M.; Sauer, J. (2024). Direct dehydrogenation of methanol to formaldehyde over ZnO–SiO -based catalysts. Catalysis Science and Technology, 14 (17), 4958–4967. doi:10.1039/D4CY00541D  

Chowdhury, C. (2024). Bayesian Optimization for Efficient Prediction of Gas Uptake in Nanoporous Materials. ChemPhysChem, 25 (16), Art.-Nr.: e202300850. doi:10.1002/cphc.202300850 

Das, S.; Kahnt, M.; van Valen, Y.; Bergh, T.; Blomberg, S.; Lyubomirskiy, M.; Schroer, C. G.; Venvik, H. J.; Sheppard, T. L. (2024). Restructuring of Ag catalysts for methanol to formaldehyde conversion studied using in situ X-ray ptychography and electron microscopy. Catalysis Science & Technology, 14 (20), 5885–5898. doi:10.1039/D4CY00770K  

Das, S.; Stuckelberger, M. E.; Pottbacker, J.; Jakobtorweihen, S.; Schroer, C. G.; Horn, R.; Sheppard, T. L. (2024). Quantitative Chemical Mapping of Pt/Rh Gauze Catalysts for Ammonia Oxidation using Resonant X-ray Tomography. The Journal of Physical Chemistry C, 128 (12), 5053–5063. doi:10.1021/acs.jpcc.4c00041  

Davari, S.; Cárdenas, C.; Hettel, M.; Lott, P.; Tischer, S.; Angeli, S.; Deutschmann, O. (2024). Spatially Resolved Measurements in a Stagnation‐Flow Reactor: Kinetics of Catalytic NH 3 Decomposition. Chemie Ingenieur Technik, 96 (12), 1735–1750. doi:10.1002/cite.202400100  

Delrieux, T.; Sharma, S.; Maurer, F.; Dolcet, P.; Lausch, M.; Zimina, A.; Cárdenas, C.; Lott, P.; Casapu, M.; Sheppard, T. L.; Grunwaldt, J.-D. (2024). A laboratory scale fast characterizing feedback loop for optimizing technical emission control catalysts. Reaction Chemistry & Engineering, 9 (11), 2868–2881. doi:10.1039/D4RE00168K  

Dolling, D. S.; Chen, J.; Schober, J.-C.; Creutzburg, M.; Jeromin, A.; Vonk, V.; Sharapa, D. I.; Keller, T. F.; Plessow, P. N.; Noei, H.; Stierle, A. (2024). Probing Active Sites on Pd/Pt Alloy Nanoparticles by CO Adsorption. ACS Nano, 18 (45), 31098–31108. doi:10.1021/acsnano.4c08291  

Düll, A.; Cros-Le Lagadec, A.; Buchmüller, J.; Häber, T.; Ates̗ C.; Börnhorst, M. (2024). Intensifying interfacial oscillations in falling film flows over rectangular corrugations. Physics of Fluids, 36 (9), Art.-Nr.: 092107. doi:10.1063/5.0222760  

Dutzi, J.; Boukis, N.; Sauer, J. (2024). Investigating Salt Precipitation in Continuous Supercritical Water Gasification of Biomass. Processes, 12 (5), Art.-Nr.: 935. doi:10.3390/pr12050935  

Dutzi, J.; Boukis, N.; Sauer, J. (2024). Supercritical water gasification of heavy metal contaminated plants with focus on separation of heavy metal contaminants. Biomass and Bioenergy, 182, Article no: 107059. doi:10.1016/j.biombioe.2024.107059  

Dutzi, J.; Stoll, I. K.; Boukis, N.; Sauer, J. (2024). Screening of ten different plants in the process of supercritical water gasification. Sustainable Chemistry for the Environment, 5, Art.-Nr.: 100062. doi:10.1016/j.scenv.2024.100062  

Ekici, E.; Yildiz, G.; Yildiz, M. J.; Kalinowska, M.; Şeker, E.; Wang, J. (2024). Continuous flow pyrolysis of virgin and waste polyolefins: a comparative study, process optimization and product characterization. Frontiers of Chemical Science and Engineering, 18 (6), Art.-Nr.: 70. doi:10.1007/s11705-024-2429-x 

Eldridge, T. J.; Borchers, M.; Lott, P.; Grunwaldt, J.-D.; Doronkin, D. E. (2024). Elucidating the Role of the State of Pd in the H-SCR of NO by Operando XANES and DRIFTS. Catalysis Science & Technology. doi:10.1039/D4CY00574K  

E-Moghaddam, M.; Dahmen, N.; Santo, U.; Sauer, J. (2024). Gasoline Synthesis from Biomass-Derived Syngas Comparing Different Methanol and Dimethyl Ether Pathways by Process Simulation, Based on the Bioliq Process. Energy & Fuels, 38 (5), 4229–4243. doi:10.1021/acs.energyfuels.3c04524  

Enss, A. E.; Huber, P.; Plessow, P. N.; Studt, F. (2024). Methanol-Mediated Hydrogen Transfer Reactions at Surface Lewis Acid Sites of H-SSZ-13. The Journal of Physical Chemistry C, 128 (37), 15367–15379. doi:10.1021/acs.jpcc.4c03408  

Enss, A. E.; Plessow, P. N.; Studt, F. (2024). Theoretical investigation of the paring mechanism of the MTO process in different zeolites. Journal of Catalysis, 432, Art.-Nr.: 115363. doi:10.1016/j.jcat.2024.115363  

Fan, Y.; Li, Q.; Fonseca, F. G.; Song, J.; Gong, M. (2024). Optimizing the Extraction of Sugars from Sewage Sludge Using Ultrasound Combined with Thermal–Alkali. Water (Switzerland), 16 (9), Art.-Nr.: 1289. doi:10.3390/w16091289  

Fonseca, F. G.; Funke, A. (2024). Modeling Fast Pyrolysis of Waste Biomass: Improving Predictive Capability. Energy and Fuels, 38 (10), 8762–8776. doi:10.1021/acs.energyfuels.3c05233  

Fonseca, F. G.; Funke, A. (2024). Modeling of Liquid–Vapor Phase Equilibria of Pyrolysis Bio-oils: A Review. Industrial & Engineering Chemistry Research, 63 (31), 13401–13420. doi:10.1021/acs.iecr.4c00775  

Freund, H.; Sauer, J.; Ehrhardt, K. (2024). Die Fachsektion Chemische Reaktionstechnik von DECHEMA und VDI hat sich neu formiert. Chemie Ingenieur Technik, 96 (6), 719. doi:10.1002/cite.202400059 

Gashnikova, D.; Maurer, F.; Bauer, M. R.; Bernart, S.; Jelic, J.; Lützen, M.; Maliakkal, C. B.; Dolcet, P.; Studt, F.; Kübel, C.; Damsgaard, C. D.; Casapu, M.; Grunwaldt, J.-D. (2024). Lifecycle of Pd Clusters: Following the Formation and Evolution of Active Pd Clusters on Ceria During CO Oxidation by In Situ/Operando Characterization Techniques. ACS Catalysis, 14 (19), 14871–14886. doi:10.1021/acscatal.4c02077  

Guse, D.; Warmuth, L.; Herfet, M.; Adolf, K.; Zevaco, T. A.; Pitter, S.; Kind, M. (2024). Seeding as a Decisive Tool for Increasing Space-Time-Yields in the Preparation of High-Quality Cu/ZnO/ZrO₂ Catalysts. Catalysts, 14 (8), Article no: 517. doi:10.3390/catal14080517  

Hagg, D.; Eifert, A.; Troßmann, T.; Frohnapfel, B.; Marschall, H.; Wörner, M. (2024). Numerical study of liquid imbibition and contact line pinning in a sealing gap for corrosion protection of metal housings. Progress in Computational Fluid Dynamics, An International Journal, 24 (2), 65 – 77. doi:10.1504/PCFD.2024.137058 

Herzinger, E.; Wolf, M. (2024). Perspectives and Potential of Liquid Organic Hydrogen Carriers in the German Energy Scenario. Chemie Ingenieur Technik, 96 (1-2), 65–73. doi:10.1002/cite.202300227  

Hinge, V. K.; Bairagi, M.; Yadav, N.; Joshi, S. K.; Shrivastava, B. D.; Jha, S. N.; Bhattacharya, D.; Gaur, A. (2024). Investigating local coordination and electronic nature of Cu centers in the copper complexes having aspartic and glutamic acids. X-Ray Spectrometry, 53 (1), 60–68. doi:10.1002/xrs.3369  

Hodonj, D.; Borchers, M.; Zeh, L.; Hoang, G. T.; Tischer, S.; Lott, P.; Deutschmann, O. (2024). Impact of operation parameters and lambda input signal during lambda-dithering of three-way catalysts for low-temperature performance enhancement. Applied Catalysis B: Environmental, 345, Art.-Nr.: 123657. doi:10.1016/j.apcatb.2023.123657  

Hodonj, D.; Thiele, B.; Deutschmann, O.; Lott, P. (2024). Temperature-dependent frequency control of TWC operation for efficient CH and NO abatement of stoichiometric natural gas engines. Chemical Engineering Journal, 499, Art.-Nr.: 155852. doi:10.1016/j.cej.2024.155852  

Huang, J.; Klahn, M.; Tian, X.; Bartling, S.; Zimina, A.; Radtke, M.; Rockstroh, N.; Naliwajko, P.; Steinfeldt, N.; Peppel, T.; Grunwaldt, J.-D.; Logsdail, A. J.; Jiao, H.; Strunk, J. (2024). Fundamental structural and electronic understanding of palladium catalysts on nitride and oxide supports. Angewandte Chemie International Edition, Art.Nr.: e202400174. doi:10.1002/anie.202400174  

Hübner, J. L.; Lucchetti, L. E. B.; Nong, H. N.; Sharapa, D. I.; Paul, B.; Kroschel, M.; Kang, J.; Teschner, D.; Behrens, S.; Studt, F.; Knop-Gericke, A.; Siahrostami, S.; Strasser, P. (2024). Cation Effects on the Acidic Oxygen Reduction Reaction at Carbon Surfaces. ACS Energy Letters, 9 (4), 1331–1338. doi:10.1021/acsenergylett.3c02743  

Jalalinejad, A.; Yousefi Seyf, J.; Funke, A.; Dahmen, N. (2024). Phase Equilibrium Calculation of Bio-Oil-Related Molecules Using Predictive Thermodynamic Models. Energy and Fuels, 38 (4), 3171 – 3185. doi:10.1021/acs.energyfuels.3c04395  

Jordt, P.; Osterhoff, M.; Tymoshenko, Y.; Hakim, B.; Dolcet, P.; Maurer, F.; Biniyaminov, V.; Amelung, L.; Dall’Antonia, F.; Grunwaldt, J.-D.; Weber, F.; Lohstroh, W.; Murphy, B. M. (2024). Specifications for Electronic Laboratory Notebooks (ELN) in the Photon and Neutron Community. Synchrotron Radiation News, 37 (6), 3–8. doi:10.1080/08940886.2024.2432265  

Kesari, A. S.; Chaganti, S. K.; Chowdhury, C. (2024). Quantum simulation of small molecules for multiple applications. Chemical Physics, 580, Art.-Nr.: 112195. doi:10.1016/j.chemphys.2024.112195 

Klag, L.; Baumgarten, L.; Gaur, A.; Sheppard, T. L.; Grunwaldt, J.-D. (2024). Comparison of Structure and Reactivity of Hydrothermally Prepared Bi‐Mo‐Co‐Fe‐O Catalysts in Selective Propylene and Isobutene Oxidation. ChemCatChem, Art.-Nr.: e202301470. doi:10.1002/cctc.202301470  

Klag, L.; Gläser, R.; Krewer, U.; Reuter, K.; Grunwaldt, J.-D. (2024). Special Collection: Catalysts and Reactors under Dynamic Conditions for Energy Storage and Conversion. ChemCatChem, 16 (21), Art.-Nr.: 202401191. doi:10.1002/cctc.202401191 

Klag, L.; Weber, S.; Horn, R.; Sheppard, T. L.; Grunwaldt, J.-D. (2024). Exploring structure, temperature and activity correlations in the selective oxidation of lower olefins over Bi-Mo-Co-Fe-O catalysts by spatial reactor profile measurements. Catalysis Science & Technology, 14 (4), 863–877. doi:10.1039/D3CY01445B  

Kramarenko, A. S.; Sharapa, D. I.; Pidko, E. A.; Studt, F. (2024). Ab Initio Kinetics of Electrochemical Reactions Using the Computational Fc 0 /Fc + Electrode. The Journal of Physical Chemistry A, 128 (41), 9063–9070. doi:10.1021/acs.jpca.4c04923  

Kuhn, C.; Kirn, M.; Tischer, S.; Deutschmann, O. (2024). Micron-sized iron particles as energy carrier: Cycling experiments in a fixed-bed reactor. Proceedings of the Combustion Institute, 40 (1-4), 105207. doi:10.1016/j.proci.2024.105207  

Kuhn, C.; Knapp, A.; Deutschmann, M. P.; Spielmann, J.; Tischer, S.; Kramm, U. I.; Nirschl, H.; Deutschmann, O. (2024). Iron as Recyclable Metal Fuel: Unraveling Oxidation Behavior and Cyclization Effects Through Thermogravimetric Analysis, Wide‐Angle X‐ray Scattering and Mössbauer Spectroscopy. ChemSusChem, 17 (15), e202400351. doi:10.1002/cssc.202400351  

Lacerda de Oliveira Campos, B.; Oliveira Souza da Costa, A.; Herrera Delgado, K.; Pitter, S.; Sauer, J.; Ferreira da Costa Junior, E. (2024). Development of a surrogate artificial neural network for microkinetic modeling: case study with methanol synthesis. Reaction Chemistry & Engineering, 9 (5), 1047–1060. doi:10.1039/d3re00409k  

Lausch, M.; Zimina, A.; Bao, J.; Pashminehazar, R.; Etzold, B. J. M.; Kramm, U. I.; Grunwaldt, J.-D.; Hussong, J. (2024). New insights into the dissolution mechanisms of iron oxides and combusted iron particles in oxalic acid. The Journal of Chemical Physics, 161 (19), 194308. doi:10.1063/5.0229410  

Liccardo, G.; Cendejas, M. C.; Mandal, S. C.; Stone, M. L.; Porter, S.; Nhan, B. T.; Kumar, A.; Smith, J.; Plessow, P. N.; Cegelski, L.; Osio-Norgaard, J.; Abild-Pedersen, F.; Chi, M.; Datye, A. K.; Bent, S. F.; Cargnello, M. (2024). Unveiling the Stability of Encapsulated Pt Catalysts Using Nanocrystals and Atomic Layer Deposition. Journal of the American Chemical Society, 146 (34), 23909–23922. doi:10.1021/jacs.4c06423 

Lott, P.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2024). A review on exhaust gas after-treatment of lean-burn natural gas engines – From fundamentals to application. Applied Catalysis B: Environmental, 340, Art.Nr.: 123241. doi:10.1016/j.apcatb.2023.123241  

Mahayni, Y.; Maurer, L.; Auer, F.; Hutzler, A.; Wasserscheid, P.; Wolf, M. (2024). Structure sensitivity of the low temperature dehydrogenation of perhydro (di)benzyltoluene on supported platinum nanoparticles. Catalysis Science & Technology, 14 (18), 5464–5473. doi:10.1039/D4CY00032C  

Marchuk, V.; Sharapa, D. I.; Grunwaldt, J.-D.; Doronkin, D. E. (2024). Surface States Governing the Activity and Selectivity of Pt-Based Ammonia Slip Catalysts for Selective Ammonia Oxidation. ACS Catalysis, 14 (2), 1107–1120. doi:10.1021/acscatal.3c05019  

Martins, T.; Sá, M. S. de; Silva, W. R.; Carriel Schmitt, C.; Moreira, R.; Raffelt, K.; Dahmen, N.; Wisniewski, A., Jr. (2024). Sugarcane biorefinery: Unlocking the potential of the pyrolytic process to convert waste biomasses into value-added products. Energy Conversion and Management, 318, 118913. doi:10.1016/j.enconman.2024.118913 

Maurer, L. A.; Pham, C. v.; Fritsch, B.; Jeppesen, H. S.; Etter, M.; Hutzler, A.; Neder, R. B.; Wolf, M.; Auer, F.; Thiele, S.; Wasserscheid, P. (2024). Improving Hydrogen Release From Oxygen‐Functionalized LOHC Molecules by Ru Addition to Pt/C Catalysts. ChemCatChem, e202400375. doi:10.1002/cctc.202400375  

Mehdipour, F.; Delrieux, T.; Maurer, F.; Grunwaldt, J.-D.; Klahn, C.; Dittmeyer, R. (2024). Opportunities and limitations of metal additive manufacturing of structured catalytic converters. Catalysis Communications, 187, 106873. doi:10.1016/j.catcom.2024.106873  

Minden, S.; Grünberger, A.; van der Schaaf, U.; Neumann, A.; Rösch, C.; Sauer, J.; Kaster, A.-K. (2024). Producing food from CO2 using microorganisms: Lots to do, little to lose!. Trends in Food Science & Technology, 154, Article no: 104778. doi:10.1016/j.tifs.2024.104778 

Mockenhaupt, B.; Gieser, J.; Najafishirtari, S.; Baumgarten, L.; Jelic, J.; Lunkenbein, T.; Ras, E.-J.; Grunwaldt, J.-D.; Studt, F.; Behrens, M. (2024). On the secondary promotion effect of Al and Ga on Cu/ZnO methanol synthesis catalysts. Journal of Catalysis, 439, Art.-Nr.: 115785. doi:10.1016/j.jcat.2024.115785 

Mokashi, M.; Bhimrao Shirsath, A.; Lott, P.; Müller, H.; Tischer, S.; Maier, L.; Deutschmann, O. (2024). Understanding of gas-phase methane pyrolysis towards hydrogen and solid carbon with detailed kinetic simulations and experiments. Chemical Engineering Journal, 479, Art.Nr.: 147556. doi:10.1016/j.cej.2023.147556  

Mokashi, M.; Shirsath, A. B.; Çelik, A.; Lott, P.; Müller, H.; Tischer, S.; Maier, L.; Bode, J.; Schlereth, D.; Scheiff, F.; Flick, D.; Bender, M.; Ehrhardt, K.; Deutschmann, O. (2024). Methane pyrolysis in packed bed reactors: Kinetic modeling, numerical simulations, and experimental insights. Chemical Engineering Journal, 485, Art.-Nr.: 149684. doi:10.1016/j.cej.2024.149684  

Mokashi, M.; Shirsath, A. B.; Demir, S.; Çelik, A.; Lott, P.; Tischer, S.; Deutschmann, O. (2024). Kinetics of thermal dry reforming of methane for syngas production and solid carbon capture. Reaction Chemistry & Engineering, 9 (11), 2902–2914. doi:10.1039/d4re00312h  

Münzer, P.; Arnold, U.; Sauer, J. (2024). Process Design for the Directly Coupled Production of Methanol and Formaldehyde Based on CO. Chemie Ingenieur Technik, 96 (6), 819–825. doi:10.1002/cite.202300183  

Nazari, P.; Zimmermann, J.; Melzer, C.; Kowalsky, W.; Aghassi-Hagmann, J.; Hernandez-Sosa, G.; Lemmer, U. (2024). High‐Resolution Printed Ethylene Vinyl Acetate Based Strain Sensor for Impact Sensing. Advanced Sensor Research, 3 (7), Art.-Nr.: 2300189. doi:10.1002/adsr.202300189  

Neukum, D.; Lakshmi Nilayam, A. R.; Ludwig, M. E.; Vadarlis, A. A.; Grunwaldt, J.-D.; Saraçi, E. (2024). Correction: Continuous flow oxidation of HMF using a supported AuPd-alloy. Catalysis Science & Technology, 14 (8), Art.-Nr.: 2306. doi:10.1039/d4cy90028f  

Neukum, D.; Lakshmi Nilayam, A. R.; Ludwig, M. E.; Vadarlis, A. A.; Grunwaldt, J.-D.; Saraçi, E. (2024). Continuous flow oxidation of HMF using supported AuPd-alloy. Catalysis Science & Technology, 14 (8), 2130–2138. doi:10.1039/D3CY01722B  

Neukum, D.; Ludwig, M. E.; Uzunidis, G.; Lakshmi Nilayam, A. R.; Krause, B.; Behrens, S.; Grunwaldt, J.-D.; Saraçi, E. (2024). Synergy of Ag and Pd in bimetallic catalysts for the selective oxidation of 5-(hydroxymethyl)furfural. Catalysis Science & Technology. doi:10.1039/D4CY01028K  

Neukum, D.; Saraci, E.; Krause, B.; Nilayam, A. R. L.; Sinigalia, A.; Grunwaldt, J.-D. (2024). Pushing the Efficiency of the Selective and Base‐free Air‐Oxidation of HMF by Varying the Properties of Carbon‐based Supports. ChemCatChem, 16 (10), e202301228. doi:10.1002/cctc.202301228  

Neukum, D.; Saraçi, E.; Wüst, D.; Raj Lakshmi Nilayam, A.; Sharma, S.; Grunwaldt, J.-D. (2024). Rational process design for the efficient oxidation of crude HMF-solution using AuPd/C catalysts. Catalysis Today, 432, Article no: 114615. doi:10.1016/j.cattod.2024.114615  

Nikolajsen, M. T.; Grivel, J.-C.; Gaur, A.; Hansen, L. P.; Baumgarten, L.; Schjødt, N. C.; Mentzel, U. V.; Grunwaldt, J.-D.; Sehested, J.; Christensen, J. M.; Høj, M. (2024). Surface ZnO on zirconia is highly active for high temperature methanol synthesis. Journal of Catalysis, 431, Art.-Nr.: 115389. doi:10.1016/j.jcat.2024.115389  

Niksirat, M.; Aeenjan, F.; Pierantozzi, M.; Jalalinejad, A.; Khosharay, S. (2024). Modeling the viscosity of (water + methanol), (water + ethanol), (water + 1-propanol) and (water + 2-propanol) mixture up to the high pressures. Brazilian Journal of Chemical Engineering. doi:10.1007/s43153-024-00515-2 

Otroshchenko, T.; Sharapa, D. I.; Fedorova, E. A.; Zhao, D.; Kondratenko, E. V. (2024). Highly Efficient Low‐loaded PdOx/AlSiOx for Ethylene Dimerization. Angewandte Chemie International Edition, 63 (44), e202410646. doi:10.1002/anie.202410646 

Paripsa, S.; Gaur, A.; Förste, F.; Doronkin, D. E.; Malzer, W.; Schlesiger, C.; Kanngießer, B.; Welter, E.; Grunwaldt, J.-D.; Lützenkirchen-Hecht, D. (2024). RefXAS: an open access database of X-ray absorption spectra. Journal of Synchrotron Radiation, 31 (5), 1105–1117. doi:10.1107/S1600577524006751  

Parku, G. K.; Funke, A.; Dahmen, N. (2024). Influence of selected quench media used for direct contact condensation on yield and composition of fast pyrolysis bio-oils aided by thermodynamic phase equilibria modelling. Separation and Purification Technology, 341, Art.-Nr.: 126873. doi:10.1016/j.seppur.2024.126873  

Parku, G. K.; Pulicanti, S. R.; Funke, A.; Dahmen, N. (2024). Phase Equilibria Aided Optimization of Levoglucosan Extraction during Condensation of Fast Pyrolysis Bio-Oils. Energy and Fuels, 38 (15), 14343–14350. doi:10.1021/acs.energyfuels.4c01097  

Pazos Urrea, M.; Meilinger, S.; Herold, F.; Gopakumar, J.; Tusini, E.; De Giacinto, A.; Zimina, A.; Grunwaldt, J.-D.; Chen, D.; Rønning, M. (2024). Aqueous Phase Reforming over Platinum Catalysts on Doped Carbon Supports: Exploring Platinum–Heteroatom Interactions. ACS Catalysis, 14 (6), 4139–4154. doi:10.1021/acscatal.3c05385  

Perret, L.; Boukis, N.; Sauer, J. (2024). Synthesis gas fermentation at high cell density: How pH and hydrogen partial pressure affect productivity and product ratio in continuous fermentation. Bioresource Technology, 391 (Part A), Art.-Nr.: 129894. doi:10.1016/j.biortech.2023.129894  

Potter, M. E.; Spiske, L.; Plessow, P. N.; McShane, E. B.; Carravetta, M.; Oakley, A. E.; Bere, T.; Carter, J. H.; Vandegehuchte, B. D.; Kaźmierczak, K. M.; Studt, F.; Raja, R. (2024). Combining computational and experimental studies to gain mechanistic insights for n -butane isomerisation with a model microporous catalyst. Catalysis Science & Technology, 14 (24), 7140–7151. doi:10.1039/d4cy01035c  

Prestigiacomo, C.; Fan, Y.; Hornung, U.; Dahmen, N.; Scialdone, O.; Galia, A. (2024). Hydrothermal liquefaction of sewage sludge: use of HCOOH and KOH to improve the slurry pumpability in a continuously operated plant. Heliyon, 10 (4), Art.-Nr.: e26287. doi:10.1016/j.heliyon.2024.e26287  

Rang, F.; Delrieux, T.; Maurer, F.; Flecken, F.; Grunwaldt, J.-D.; Hanf, S. (2024). Supported Binuclear Gold Phosphine Complexes as CO Oxidation Catalysts: Insights into the Formation of Surface‐Stabilized Au Particles. Small Science, 4 (12). doi:10.1002/smsc.202400345  

Reich, J.; Kaiser, S.; Heiz, U.; Grunwaldt, J.-D.; Kappes, M. M.; Esch, F.; Lechner, B. A. J. (2024). A Critical View on the Quantification of Model Catalyst Activity. Topics in Catalysis, 67 (13-14), 880–891. doi:10.1007/s11244-024-01920-0  

Rex, A.; Almeida De Campos, L.; Gottschalk, T.; Ferreira Sanchez, D.; Trinke, P.; Czioska, S.; Saraçi, E.; Bensmann, B.; Grunwaldt, J.-D.; Hanke-Rauschenbach, R.; Sheppard, T. L. (2024). Elemental Distribution in Catalyst‐Coated Membranes of Proton Exchange Membrane Water Electrolysers Tracked by Synchrotron X‐Ray Fluorescence. Advanced Energy and Sustainability Research, 5 (9), Art.-Nr.: 2400048. doi:10.1002/aesr.202400048  

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 CoCuGa/SiO to identify stability-issues in ethanol-selective Co-Cu alloyed catalysts in carbon monoxide hydrogenation. Applied Catalysis A: General, 675, 119636. doi:10.1016/j.apcata.2024.119636  

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-edge X-ray spectroscopy of rhodium and palladium compounds. Journal of Synchrotron Radiation, 31 (4). doi:10.1107/S1600577524004673 

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 Hydrogenation over Cu/ZrO: Insights into the Role of the Support and the Active Sites. ACS Catalysis, 14 (18), 14127 – 14138. doi:10.1021/acscatal.4c03803 

Villagra-Soza, F.; Vergara, T.; Godoy, S.; Karelovic, A.; Jiménez, R. (2024). Unraveling the mechanistic interplay between CO and CO hydrogenation over Ni, Co, and NiCo catalysts. Journal of Catalysis, 438, 115726. doi:10.1016/j.jcat.2024.115726 

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 Hydrogenation to Methanol over Single‐Site Zirconium on Amorphous Silica. Angewandte Chemie - International Edition, 63 (4), Art.Nr.: e202312292. doi:10.1002/anie.202312292  

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 on propane non-oxidative dehydrogenation over supported Co/ZrO catalysts. Journal of Catalysis, 432, Art.-Nr.: 115440. doi:10.1016/j.jcat.2024.115440 

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  

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. 

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  

Arnold, U.; Drexler, M.; Fuchs, C.; Niethammer, B.; Sauer, J. (2024, Juli 12). Fuels from methanol: Recent developments and perspectives. Satellite Conference of the 18th International Congress on Catalysis (C1Chem 2024), Lille, Frankreich, 10.–12. Juli 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, Deutschland, 6.–8. Mai 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, Frankreich, 24.–27. Juni 2024. 

Dutzi, J.; Vadarlis, A.; Boukis, N.; Sauer, J. (2024, Juli 30). Hydrothermal gasification: a pathway to renewable energy from contaminated biomass. ENERGY TRANSITION ON FARMS Renewable Sources and Electrification (Summer School 2024), Pieve Tesino, Italien, 29. Juli–3. August 2024. 

Habes, C.; Bagheri, M.; Bodziony, F.; Wörner, M.; Marschall, H. (2024, Juni 26). phaseFieldFoam - A framework for multiphase flows using the phase field method. 5th International Conference on Numerical Methods in Multiphase Flows (ICNMMF 2024), Reykjavík, Island, 26.–28. Juni 2024.  

Schrader, W.; Mueller, D.; Düll, A.; Häber, T.; Stroh, A. (2024, Juni). 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), Reykjavík, Island, 26.–28. Juni 2024.  

Wörner, M. (2024, Oktober 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, Österreich, 27.–30. Oktober 2024.  

Drexler, M.; Zaghini Francesconi, V.; Arnold, U.; Zevaco, T.; Sauer, J. (2024, März). Demonstration and evaluation of continuous, DME-based oxymethylene ether (OME) production in a liquid phase process. 57. Jahrestreffen Deutscher Katalytiker (2024), Weimar, Deutschland, 13.–15. März 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, Deutschland, 27.–28. Februar 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, Deutschland, 30. September–2. Oktober 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, Griechenland, 23. April 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, Frankreich, 24.–27. Juni 2024. 

Ioannidou, G.; Drexler, M.; Arnold, U.; Sauer, J.; Lemonidou, A. A. (2024, Juli). Butadiene from biomass derivatives over Re-Mo based catalysts. 18th International Congress on Catalysis (ICC 2024), Lyon, Frankreich, 14.–19. Juli 2024. 

Lacerda de Oliveira Campos, B.; Beeskow, P.; Drexler, M.; Delgado, K. H.; Arnold, U.; Sauer, J. (2024, Mai). 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, Deutschland, 6.–8. Mai 2024. 

Münzer, P.; Arnold, U.; Sauer, J. (2024, Juni). Improving Overall Hydrogen Utilization by Direct Coupling of Methanol and Formaldehyde Production in a CO-based Process Chain. 28th International Symposium for Chemical Reaction Engineering (ISCRE 2024), Turku, Finnland, 16.–19. Juni 2024. 

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, Mai). Research Data Management and Data Flow in ROCK-IT. 15th International Particle Accelerator Conference (IPAC 2024), Nashville, TN, USA, 19.–24. Mai 2024. 

Zaghini Francesconi, V.; Drexler, M.; Arnold, U.; Sauer, J. (2024, Mai). Synthesis of oxymethylene ethers (OME) based on technical alcohol mixtures. Annual Meeting on Reaction Engineering and Electrochemical Processes (2024), Würzburg, Deutschland, 6.–8. Mai 2024. 

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, Februar 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, Februar 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, Februar 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, Februar 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, Mai 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, Mai 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, Mai 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, Juni 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, Juli 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, Juli 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, März 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, Januar 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, März 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, Juli 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 

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 

Yang, M.; Yu, J.; Zimina, A.; Sarma, B. B.; Grunwaldt, J.-D.; Zada, H.; Wang, L.; Sun, J. (2024, Januar 22). Inside Back Cover: Unlocking a Dual‐Channel Pathway in CO Hydrogenation to Methanol over Single‐Site Zirconium on Amorphous Silica. John Wiley and Sons. doi:10.1002/anie.202319538 

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 

Amsler, J. (2023, Mai 3). Development of Anharmonic Molecular Models and Simulation of Reaction Kinetics in Zeolite Catalysis. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000158254  

Baehr, C. (2023, Februar 14). Charakterisierung des Alterungsverhaltens von Pyrolyseöl sowie dessen Stabilisierung und Konditionierung mit Ethanol und verdichtetem CO₂. 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. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000161161  

Delgado Otalvaro, N. (2023, Februar 1). Semi-mechanistic, data-based, and hybrid models: A comprehensive comparison on the example of the direct DME synthesis from CO2-rich synthesis gas. 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. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000161174  

Hakimioun, A. H. (2023, Oktober 20). Theoretical Studies on the Influence of Size and Support Interactions of Copper Catalysts for CO2 Hydrogenation to Methanol. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000162772  

Kövilein, A. (2023, Juni 26). From acetate to value-added products: L-malic acid production with Aspergillus oryzae. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000159501  

Lacerda de Oliveira Campos, B. (2023, Mai 8). Multiscale modeling of the methanol synthesis: from surface reaction kinetics to techno-economic analysis. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000158433  

Neuner, P. (2023, August 4). Hydroprocessing von synthetischen Wachsen zur Schmiermittelproduktion. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000161117  

Pandit, L. (2023, Mai 25). Unravelling structural dynamics in Cu/ZnO-based methanol catalysts for future Power-to-Liquid applications. Dissertation. Karlsruher Institut für Technologie (KIT). 

Weber, S. (2023, Juli 17). Revealing Porosity and Structure of Ni-based Catalysts for Dynamic CO Methanation with Hard X-rays. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000160428  

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 Solubility in Fast Pyrolysis Bio-oil. Industrial & Engineering Chemistry Research, 62 (38), 15378–15385. doi:10.1021/acs.iecr.3c02070  

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 NbO and Its Polymorphs as Catalyst Supports for Pyrolysis Oil Upgrading through Hydrodeoxygenation. Energy & Fuels, 37 (14), 10474–10492. doi:10.1021/acs.energyfuels.3c01152  

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 Methanation Reaction. Chemie Ingenieur Technik, 95 (5), 658–667. doi:10.1002/cite.202200204  

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 PdCl octagons built up by PdCl(NO) moieties. Zeitschrift für anorganische und allgemeine Chemie, 649 (6-7). doi:10.1002/zaac.202200337  

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 Hydrogenation to Methanol over CuO Nanocubes Supported on ZnO. Journal of the American Chemical Society, 145 (5), 3016–3030. doi:10.1021/jacs.2c11540  

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 -Doped Calcium Molybdate Nanophosphors: A Systematic Comparison with Batch Synthesis. ACS Applied Nano Materials, 6 (17), 15510–15520. doi:10.1021/acsanm.3c02136  

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/AlO. The Journal of Physical Chemistry C, 127 (7), 3497–3505. doi:10.1021/acs.jpcc.2c08823  

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 Generation. Advanced Materials, 35 (32), Art.-Nr.: 2211814. doi:10.1002/adma.202211814  

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 Nanosheets and Strongly Enhanced Photocatalytic H Evolution. ACS Catalysis, 13, 33–41. doi:10.1021/acscatal.2c04481  

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  

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.  

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, Hrsg.), Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000159935  

Arnold, U.; Drexler, M.; Fuchs, C.; Niethammer, B.; Sauer, J. (2023). Alternative fuels from renewables: The role of methanol. Helmholtz Energy Conference (2023), Koblenz, Deutschland, 12.–13. Juni 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, Deutschland, 23.–25. Mai 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, Italien, 5.–8. Juni 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, Deutschland, 12.–13. Juni 2023. 

Klag, L.; Sheppard, T.; Grunwaldt, J.-D. (2023, März 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, Deutschland, 15.–17. März 2023. 

Lacerda de Oliveira Campos, B.; Ferreira da Costa Junior, E.; Delgado, K. H.; Oliveira Souza da Costa, A.; Pitter, S.; Sauer, J. (2023, Juni 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, 18.–23. Juni 2023. 

Lacerda de Oliveira Campos, B.; Ferreira da Costa Junior, E.; Herrera Delgado, K.; Oliveira Souza da Costa, A.; Pitter, S.; Sauer, J. (2023, März 17). Development of an artificial neural network to reproduce a microkinetic model for the methanol synthesis. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 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), Kyōto, Japan, 10.–14. September 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, Deutschland, 23.–24. Januar 2023. 

Treu, P.; Sarma, B. B.; Saraçi, E. (2023, März 15). Impact of Fe speciation in Fe/MFI on the oxidative cleavage of vicinal diols. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 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), Prag, Tschechien, 27. August–1. September 2023. 

Vergara, T.; Jiménez, R.; Delgado, K. H.; Lacerda de Oliveira Campos, B.; Karelovic, A. (2023, Juni). 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, 18.–23. Juni 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), Prag, Tschechien, 27. August–1. September 2023. 

Warmuth, L.; Guse, D.; Kind, M.; Steurer, M.; Schild, D.; Zimina, A.; Pitter, S. (2023, Mai 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, Deutschland, 24.–25. Mai 2023. 

Wörner, M. (2023, März 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, Deutschland, 28.–30. März 2023.  

Zhao, D.; Gao, M.; Tian, X.; Doronkin, D.; Han, S.; Rodemerck, U.; Linke, D.; Ye, M.; Jiang, G.; Jiao, H.; Kondratenko, E. (2023, März 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, Deutschland, 15.–17. März 2023. 

Baumgarten, L.; Grunwaldt, J.-D.; Saraçi, E. (2023, März 16). Operando X-Ray Absorption Spectroscopic Investigations on Ni and Cu Catalysts for CO2-Hydrogenation. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 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, Deutschland, 10. Oktober 2023.  

Czechowsky, J.; Dolcet, P.; Maliakkal, C.; Gross, S.; Behrens, S.; Kübel, C.; Grunwaldt, J.-D.; Casapu, M. (2023, März 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, Deutschland, 15.–17. März 2023. 

Da Roit, N.; Czechowsky, J.; Neumaier, M.; Wang, D.; Kappes, M.; Casapu, M.; Behrens, S. (2023, März 15). Powder model catalysts based on Pt clusters, Pt and Pd nanoparticles for emission control catalysis. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 2023. 

De Oliveira, A.; Czechowsky, J.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D.; Wolf, M. (2023, März 15). One-pot synthesis of oxidation catalysts for emission control via solvent deficient precipitation. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 2023. 

Düll, A. (2023, Juni 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, Deutschland, 19.–23. Juni 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, Deutschland, 17.–21. September 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, Deutschland, 10. Mai 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, Deutschland, 10.–15. Oktober 2023. 

Elbuga-Ilica, R.; Zimina, A.; Serrer, M.; Saraçi, E.; Grunwaldt, J.-D. (2023, März 15). High pressure and long-term operando studies for production of sustainable fuels & chemicals: Bridging industry and synchrotron. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 2023. 

Kornetzky, K.; Schulte, M.; Maurer, F.; Jung, N.; Chacko, R.; Deutschmann, O.; Grunwaldt, J.-D. (2023, März 15). Towards research data management with an electronic lab notebook in catalysis. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 2023. 

Münzer, P.; Arnold, U.; Sauer, J. (2023). Directly Coupled Production of Methanol and Formaldehyde Based on CO. DGMK Conference C1 Building Blocks for Future Chemistry (2023), Dresden, Deutschland, 11.–13. Oktober 2023. 

Münzer, P.; Arnold, U.; Sauer, J. (2023). Techno-Economic Comparison of Different Implementations of Coupled CHO / CHOH Synthesis Based on CO. 14th European Congress of Chemical Engineering and 7th European Congress of Applied Biotechnology (ECCE & ECAB 2023), Berlin, Deutschland, 17.–21. September 2023. 

Münzer, P.; Arnold, U.; Sauer, J. (2023). Techno-Economic Evaluation of Directly Coupled CHO / CHOH Synthesis Based on CO. Annual Meeting on Reaction Engineering (2023), Frankfurt am Main, Deutschland, 15.–17. Mai 2023. 

Neukum, D.; Saraci, E.; Krause, B.; Sinigalia, A.; Nilayam, A. R., Lakshmi; Grundwaldt, J.-D. (2023, März 16). Rate enhancing effect of carbon support properties on Pt-catalyzed base-free HMF oxidation. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 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, Deutschland, 28. Februar–1. März 2023. 

Schmitt, C.; Czechowsky, J.; Casapu, M.; Behrens, S. (2023, März 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, Deutschland, 15.–17. März 2023. 

Schulte, M.; Sender, V.; Baumgarten, L.; Saraçi, E.; Grunwaldt, J.-D. (2023, März 15). Impact of flame spray pyrolysis parameters on the structure and activity of Cu-based CO2-methanol catalysts. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 2023. 

Sharma, S.; Delrieux, T.; Karpov, D.; Grunwaldt, J.-D.; Sheppard, T. (2023, März 15). Visualising sulphur poisoning in structured catalysts with X-ray nanotomography. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 2023. 

Vergara, T.; Gómez, D.; Collins, S.; Jiménez, R.; Karelovic, A. (2023, Juni). 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, 18.–23. Juni 2023. 

Warmuth, L. (2023, März 15). Green methanol from renewable feeds : Towards scalable catalyst synthesis and improved stability. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 2023. 

Warmuth, L.; Guse, D.; Kind, M.; Steurer, M.; Zimina, A.; Grunwaldt, J.-D.; Schild, D.; Zevaco, T.; Pitter, S. (2023, Juni 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, 18.–23. Juni 2023. 

Weber, S.; Diaz, A.; Karpov, D.; Kahnt, M.; Romanenko, Y.; Kotrel, S.; Grunwaldt, J.-D.; Schunk, S.; Sheppard, T. (2023, März 15). Probing Pore Accessibility of Coked Technical Catalysts by Hard X-ray Nanotomography. 56. Jahrestreffen Deutscher Katalytiker (2023), Weimar, Deutschland, 15.–17. März 2023. 

Marchuk, V.; Sharapa, D. I.; Grunwaldt, J.-D.; Doronkin, D. E. (2023, Oktober 17). Atomic coordinates of DFT-optimized Pt structures with O, N, and NHx species in surface or interstitial locations. doi:10.35097/1764 

Perret, L. (2023, November 5). Raw measurement data on the influence of pH and H2 partial pressure on syngas fermentation with Clostridium ljungdahlii. doi:10.17632/nnx6brc9hj.2 

Perret, L. (2023, November 5). Raw measurement data on the influence of increased cell densities on product ratio and productivity in syngas fermentation with Clostridium ljungdahlii. doi:10.17632/8gtc54zykn.1 

Fuchs, S.; Dahmen, N. (2023). „Beitrag der großindustriellen Herstellung von Re-Fuels zur Dekarbonisierung“ - Am Karlsruher Institut für Technologie wird das Refineries4Future-Projekt koordiniert. - Campus-Report am 20.06.2023. doi:10.5445/IR/1000159630 

Araujo-Lopez, E. (2022, Dezember 8). Theoretical Insights into the Light Alkanes Dehydrogenation and Aldehydes Hydrogenation on Transition Metal and Metal Oxide Surfaces. 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. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000150483  

Haltenort, P. (2022, März 3). Demonstration und Evaluation der kontinuierlichen und heterogenkatalysierten Synthese von Oxymethylendimethylethern (OME) aus Dimethylether und Trioxan. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000143343  

Siebert, M. (2022, Juli 29). Intermetallische Verbindungen als Katalysatoren für die Semi-Hydrierung von Acetylen in mikrostrukturierten Reaktoren. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000149045  

Zha, S. (2022, Oktober 12). Hierarchical Multiscale Modelling of CoCu Catalyst in CO Hydrogenation : Bridge the Gap between Microscopic and Mesoscopic Systems. Dissertation. Karlsruher Institut für Technologie (KIT). doi:10.5445/IR/1000150313  

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?. Frontiers in Climate, 4. doi:10.3389/fclim.2022.810343  

Borchers, M.; Lott, P.; Deutschmann, O. (2022). Selective Catalytic Reduction with Hydrogen for Exhaust gas after-treatment of Hydrogen Combustion Engines. Topics in Catalysis, 66 (13-14), 973–984. doi:10.1007/s11244-022-01723-1  

Campos Fraga, M. M.; Lacerda de Oliveira Campos, B.; Hendrawidjaja, H.; Carriel Schmitt, C.; Raffelt, K.; Dahmen, N. (2022). Fast Pyrolysis Oil Upgrading via HDO with Fe-Promoted Nb₂O₅-Supported Pd-Based Catalysts. Energies, 15 (13), Art.-Nr.: 4762. doi:10.3390/en15134762  

Carriel Schmitt, C.; Rapp, M.; Voigt, A.; De Carvalho, M. dos S. (2022). Selective Detection of Aromatic Compounds with a Re-Designed Surface Acoustic Wave Sensor System Using a Short Packed Column. Coatings, 12 (11), Art.-Nr.: 1666. doi:10.3390/coatings12111666  

Chawla, J.; Schardt, S.; Angeli, S.; Lott, P.; Tischer, S.; Maier, L.; Deutschmann, O. (2022). Oxidative Coupling of Methane over Pt/AlO at High Temperature: Multiscale Modeling of the Catalytic Monolith. Catalysts, 12 (2), Art.-Nr.: 189. doi:10.3390/catal12020189  

Chen, S.; Huang, X.; Schild, D.; Wang, D.; Kübel, C.; Behrens, S. (2022). Pd–In intermetallic nanoparticles with high catalytic selectivity for liquid-phase semi-hydrogenation of diphenylacetylene. Nanoscale, 14 (47), 17661–17669. doi:10.1039/D2NR03674F  

Czioska, S.; Ehelebe, K.; Geppert, J.; Escalera-López, D.; Boubnov, A.; Saraçi, E.; Mayerhöfer, B.; Krewer, U.; Cherevko, S.; Grunwaldt, J.-D. (2022). Heating up the OER: Investigation of IrO₂ OER Catalysts as Function of Potential and Temperature. ChemElectroChem, 9 (19), e202200514. doi:10.1002/celc.202200514  

Das, S.; Pashminehazar, R.; Sharma, S.; Weber, S.; Sheppard, T. L. (2022). New Dimensions in Catalysis Research with Hard X‐Ray Tomography. Chemie Ingenieur Technik, 94 (11), 1591–1610. doi:10.1002/cite.202200082  

Delgado Otalvaro, N.; Bilir, P. G.; Herrera Delgado, K.; Pitter, S.; Sauer, J. (2022). Kinetics of the Direct DME Synthesis: State of the Art and Comprehensive Comparison of Semi-Mechanistic, Data-Based and Hybrid Modeling Approaches. Catalysts, 12 (3), Art.-Nr.: 347. doi:10.3390/catal12030347  

Denisov, N.; Qin, S.; Will, J.; Vasiljevic, B. N.; Skorodumova, N. V.; Pašti, I. A.; Sarma, B. B.; Osuagwu, B.; Yokosawa, T.; Voss, J.; Wirth, J.; Spiecker, E.; Schmuki, P. (2022). Light‐induced agglomeration of single‐atom platinum in photocatalysis. Advanced Materials, 35 (5), Art.-Nr.: 2206569. doi:10.1002/adma.202206569  

De Wispelaere, K.; Plessow, P. N.; Studt, F. (2022). Toward Computing Accurate Free Energies in Heterogeneous Catalysis: a Case Study for Adsorbed Isobutene in H-ZSM-5. ACS Physical Chemistry Au, 2 (5), 399–406. doi:10.1021/acsphyschemau.2c00020  

Drexler, M.; Haltenort, P.; Arnold, U.; Sauer, J. (2022). Continuous Synthesis of Oxymethylene Ether Fuels from Dimethyl Ether in a Heterogeneously Catalyzed Liquid Phase Process. Chemie-Ingenieur-Technik, 94 (3), 256–266. doi:10.1002/cite.202100173  

Drexler, M.; Haltenort, P.; Arnold, U.; Sauer, J.; Karakoulia, S. A.; Triantafyllidis, K. S. (2022). Progress in the anhydrous production of oxymethylene ethers (OME) as a renewable diesel fuel in a liquid phase process. Catalysis Today, 424, Art.-Nr.: 113847. doi:10.1016/j.cattod.2022.07.015 

Eggart, D.; Huang, X.; Zimina, A.; Yang, J.; Pan, Y.; Pan, X.; Grunwaldt, J.-D. (2022). Operando XAS Study of Pt-Doped CeO2 for the Nonoxidative Conversion of Methane. ACS Catalysis, 12, 3897–3908. doi:10.1021/acscatal.2c00092  

Fan, Y.; Prestigiacomo, C.; Gong, M.; Tietz, T.; Hornung, U.; Dahmen, N. (2022). Comparative investigation on the value-added products obtained from continuous and batch hydrothermal liquefaction of sewage sludge. Frontiers in Environmental Science, 10, Art.Nr. 996353. doi:10.3389/fenvs.2022.996353  

Fan, Y.; Hoffmann, A.; Hornung, U.; Raffelt, K.; Zevaco, T. A.; Dahmen, N. (2022). Hydrothermal, catalyst-free production of a cyclic dipeptide from lysine. Journal of Analytical and Applied Pyrolysis, 168, Art.-Nr.: 105792. doi:10.1016/j.jaap.2022.105792  

Fan, Y.; Hornung, U.; Dahmen, N. (2022). Hydrothermal liquefaction of sewage sludge for biofuel application: A review on fundamentals, current challenges and strategies. Biomass and Bioenergy, 165, Art.-Nr.: 106570. doi:10.1016/j.biombioe.2022.106570  

Farpón, M. G.; Henao, W.; Plessow, P. N.; Andrés, E.; Arenal, R.; Marini, C.; Agostini, G.; Studt, F.; Prieto, G. (2022). Rhodium Single‐Atom Catalyst Design through Oxide Support Modulation for Selective Gas‐Phase Ethylene Hydroformylation. Angewandte Chemie - International Edition, 62 (1), Art.-Nr.: e202214048. doi:10.1002/anie.202214048  

Feofanov, M.; Sharapa, D. I.; Akhmetov, V. (2022). Alumina-mediated soft propargylic C–H activation in unactivated alkynes. Green Chemistry, 24 (12), 4761–4765. doi:10.1039/d2gc00555g  

Fonseca, F. G.; Anca-Couce, A.; Funke, A.; Dahmen, N. (2022). Challenges in Kinetic Parameter Determination for Wheat Straw Pyrolysis. Energies, 15 (19), Art.-Nr.: 7240. doi:10.3390/en15197240  

Freund, H.; Sauer, J.; Wachsen, O. (2022). Wie verändert sich die Reaktions‐ und Reaktortechnik durch die Elektrifizierung chemischer Prozesse?. Chemie Ingenieur Technik, 94 (5), 615. doi:10.1002/cite.202270502 

Fuchs, C.; Arnold, U.; Sauer, J. (2022). Effect of nickel loading on fuel production via heterogeneously catalyzed oligomerization of methanol‐based olefins. Chemie Ingenieur Technik, 94 (9), 1215–1215. doi:10.1002/cite.202255176 

Gaur, A.; Stehle, M.; Serrer, M.-A.; Stummann, M. Z.; La Fontaine, C.; Briois, V.; Grunwaldt, J.-D.; Høj, M. (2022). Using Transient XAS to Detect Minute Levels of Reversible S-O Exchange at the Active Sites of MoS2-Based Hydrotreating Catalysts: Effect of Metal Loading, Promotion, Temperature, and Oxygenate Reactant. ACS catalysis, 12 (1), 633–647. doi:10.1021/acscatal.1c04767  

Geppert, J.; Röse, P.; Czioska, S.; Escalera-López, D.; Boubnov, A.; Saraçi, E.; Cherevko, S.; Grunwaldt, J.-D.; Krewer, U. (2022). Microkinetic Analysis of the Oxygen Evolution Performance at Different Stages of Iridium Oxide Degradation. Journal of the American Chemical Society, 144 (29), 13205–13217. doi:10.1021/jacs.2c03561  

Grafmüller, J.; Böhm, A.; Zhuang, Y.; Spahr, S.; Müller, P.; Otto, T. N.; Bucheli, T. D.; Leifeld, J.; Giger, R.; Tobler, M.; Schmidt, H.-P.; Dahmen, N.; Hagemann, N. (2022). Wood Ash as an Additive in Biomass Pyrolysis: Effects on Biochar Yield, Properties, and Agricultural Performance. ACS Sustainable Chemistry & Engineering, 10 (8), Artk.Nr.: 2720–2729. doi:10.1021/acssuschemeng.1c07694  

Guo, B.; Hornung, U.; Zhang, S.; Dahmen, N. (2022). Techno‐Economic Assessment of a Microalgae Biorefinery. Chemie Ingenieur Technik, 95 (6), 950–954. doi:10.1002/cite.202200007  

Guo, B.; Yang, B.; Su, Y.; Zhang, S.; Hornung, U.; Dahmen, N. (2022). Screening and Optimization of Microalgae Biomass and Plastic Material Coprocessing by Hydrothermal Liquefaction. ACS ES&T Engineering, 2 (1), 65–77. doi:10.1021/acsestengg.1c00261  

Guo, B.; Yang, B.; Weil, P.; Zhang, S.; Hornung, U.; Dahmen, N. (2022). The Effect of Dichloromethane on Product Separation during Continuous Hydrothermal Liquefaction of Chlorella vulgaris and Aqueous Product Recycling for Algae Cultivation. Energy & fuels, 36 (2), 922–931. doi:10.1021/acs.energyfuels.1c02523  

Guse, D.; Polierer, S.; Wild, S.; Pitter, S.; Kind, M. (2022). Improved Preparation of Cu/Zn‐Based Catalysts by Well‐Defined Conditions of Co‐Precipitation and Aging. Chemie - Ingenieur - Technik, 94 (3), 314–327. doi:10.1002/cite.202100197  

Huber, P.; Studt, F.; Plessow, P. N. (2022). Reactivity of Surface Lewis and Brønsted Acid Sites in Zeolite Catalysis: A Computational Case Study of DME Synthesis Using H-SSZ-13. The Journal of Physical Chemistry C, 126 (13), 5896–5905. doi:10.1021/acs.jpcc.2c00668  

Karp, S. G.; Schmitt, C. C.; Moreira, R.; de Oliveira Penha, R.; de Mello, A. F. M.; Herrmann, L. W.; Soccol, C. R. (2022). Sugarcane Biorefineries: Status and Perspectives in Bioeconomy. BioEnergy Research, 15, 1842–1853. doi:10.1007/s12155-022-10406-4 

Keller, K.; Wan, S.; Borchers, M.; Lott, P.; Suntz, R.; Deutschmann, O.; Wan, S. (2022). Treating NOx emission of hydrogen fueled combustion engines by NOx storage and reduction catalysts: A transient kinetic study including PLIF measurements. Proceedings of the Combustion Institute, 39 (4), 4247–4256. doi:10.1016/j.proci.2022.07.027 

Kirchberger, F. M.; Liu, Y.; Plessow, P. N.; Tonigold, M.; Studt, F.; Sanchez-Sanchez, M.; Lercher, J. A. (2022). Mechanistic differences between methanol and dimethyl ether in zeolite-catalyzed hydrocarbon synthesis. Proceedings of the National Academy of Sciences of the United States of America, 119 (4), Art.-Nr. e2103840119. doi:10.1073/pnas.2103840119  

Kohansal, K.; Sharma, K.; Haider, M. S.; Toor, S. S.; Castello, D.; Rosendahl, L. A.; Zimmermann, J.; Pedersen, T. H. (2022). Hydrotreating of bio-crude obtained from hydrothermal liquefaction of biopulp: effects of aqueous phase recirculation on the hydrotreated oil. Sustainable Energy and Fuels, 6 (11), 2805–2822. doi:10.1039/D2SE00399F 

Koutsonikolas, D.; Karagiannakis, G.; Plakas, K.; Chatzis, V.; Skevis, G.; Giudicianni, P.; Amato, D.; Sabia, P.; Boukis, N.; Stoll, K. (2022). Membrane and Electrochemical Based Technologies for the Decontamination of Exploitable Streams Produced by Thermochemical Processing of Contaminated Biomass. Energies, 15 (7), Art. Nr.: 2683. doi:10.3390/en15072683  

Kreitz, B.; Lott, P.; Bae, J.; Blöndal, K.; Angeli, S.; Ulissi, Z. W.; Studt, F.; Goldsmith, C. F.; Deutschmann, O. (2022). Detailed Microkinetics for the Oxidation of Exhaust Gas Emissions through Automated Mechanism Generation. ACS Catalysis, 12 (18), 11137–11151. doi:10.1021/acscatal.2c03378 

Krstić, M.; Fink, K.; Sharapa, D. I. (2022). The Adsorption of Small Molecules on the Copper Paddle-Wheel: Influence of the Multi-Reference Ground State. Molecules, 27 (3), Art.-Nr.: 912. doi:10.3390/molecules27030912  

Kuhn, C.; Düll, A.; Rohlfs, P.; Tischer, S.; Börnhorst, M.; Deutschmann, O. (2022). Iron as recyclable energy carrier: Feasibility study and kinetic analysis of iron oxide reduction. Applications in Energy and Combustion Science, 12, Art.-Nr.: 100096. doi:10.1016/j.jaecs.2022.100096  

Lacerda de Oliveira Campos, B.; John, K.; Beeskow, P.; Herrera Delgado, K.; Pitter, S.; Dahmen, N.; Sauer, J. (2022). A Detailed Process and Techno-Economic Analysis of Methanol Synthesis from H₂ and CO₂ with Intermediate Condensation Steps. Processes, 10 (8), Art.-Nr.: 1535. doi:10.3390/pr10081535  

Li, H.; Jelic, J.; Studt, F. (2022). The barrier free splitting of O-H bond in HO and CHOH due to the synergetic effects of single atom (Cu/Fe) coordination change and ZnO(1 1 0) surface oxygen activation. Applied Surface Science, 576, Art.Nr. 151750. doi:10.1016/j.apsusc.2021.151750 

Liu, S.; Yang, C.; Zha, S.; Sharapa, D.; Studt, F.; Zhao, Z.-J.; Gong, J. (2022). Moderate Surface Segregation Promotes Selective Ethanol Production in CO Hydrogenation Reaction over CoCu Catalysts. Angewandte Chemie - International Edition, 61 (2), e202109027. doi:10.1002/anie.202109027  

Ma, M.; Huang, Z.; Doronkin, D. E.; Fa, W.; Rao, Z.; Zou, Y.; Wang, R.; Zhong, Y.; Cao, Y.; Zhang, R.; Zhou, Y. (2022). Ultrahigh surface density of Co-N₂C single-atom-sites for boosting photocatalytic CO₂ reduction to methanol. Applied catalysis / B, 300, Art.-Nr.: 120695. doi:10.1016/j.apcatb.2021.120695  

Mantei, F.; Ali, R. E.; Baensch, C.; Voelker, S.; Haltenort, P.; Burger, J.; Dietrich, R.-U.; Assen, N. von der; Schaadt, A.; Sauer, J.; Salem, O. (2022). Techno-economic assessment and carbon footprint of processes for the large-scale production of oxymethylene dimethyl ethers from carbon dioxide and hydrogen. Sustainable energy & fuels, 6 (3), 528–549. doi:10.1039/D1SE01270C  

Marchuk, V.; Huang, X.; Murzin, V.; Grunwaldt, J.-D.; Doronkin, D. E. (2022). Operando QEXAFS Study of Pt–Fe Ammonia Slip Catalysts During Realistic Driving Cycles. Topics in Catalysis, 66 (13-14), 825–838. doi:10.1007/s11244-022-01718-y  

Maurer, F.; Beck, A.; Jelic, J.; Wang, W.; Mangold, S.; Stehle, M.; Wang, D.; Dolcet, P.; Gänzler, A. M.; Kübel, C.; Studt, F.; Casapu, M.; Grunwaldt, J.-D. (2022). Surface Noble Metal Concentration on Ceria as a Key Descriptor for Efficient Catalytic CO Oxidation. ACS catalysis, 12, 2473–2486. doi:10.1021/acscatal.1c04565  

Mrosk, C.; Kolb, T.; Stapf, D.; Sauer, J. (2022). CarbonCycleLab: Wasserstoff für die Circular Economy = CarbonCycleLab: Hydrogen for the Circular Economy. LookIT. LookKIT : Das Magazin für Forschung, Lehre, Innovation, (01/2022), 38–41. 

Neukum, D.; Baumgarten, L.; Wüst, D.; Sarma, B. B.; Saraçi, E.; Kruse, A.; Grunwaldt, J.-D. (2022). Challenges of green FDCA production from bio‐derived HMF: Overcoming deactivation by concomitant amino acids. ChemSusChem, 15 (13), e202200418. doi:10.1002/cssc.202200418  

Pandit, L.; Serrer, M.-A.; Saraҫi E.; Boubnov, A.; Grunwaldt, J.-D. (2022). Versatile in situ/operando Setup for Studying Catalysts by X-Ray Absorption Spectroscopy under Demanding and Dynamic Reaction Conditions for Energy Storage and Conversion. Chemistry methods, 2 (1), e202100078. doi:10.1002/cmtd.202100078 

Perret, L.; Boukis, N.; Sauer, J. (2022). Methods of reaction and reactor engineering to adjust product ratios and increase efficiency of syngas fermentation with Clostridium ljungdahlii. Chemie Ingenieur Technik, 94 (9), 1252. doi:10.1002/cite.202255034 

Perret, L.; Lacerda de Oliveira Campos, B.; Herrera Delgado, K.; Zevaco, T. A.; Neumann, A.; Sauer, J. (2022). CO Fixation to Elementary Building Blocks: Anaerobic Syngas Fermentation vs. Chemical Catalysis. Chemie Ingenieur Technik, 94 (11), 1667–1687. doi:10.1002/cite.202200153  

Plessow, P. N.; Campbell, C. T. (2022). Influence of Adhesion on the Chemical Potential of Supported Nanoparticles as Modeled with Spherical Caps. ACS Catalysis, 12 (4), 2302–2308. doi:10.1021/acscatal.1c04633  

Plessow, P. N.; Enss, A. E.; Huber, P.; Studt, F. (2022). A new mechanistic proposal for the aromatic cycle of the MTO process based on a computational investigation for H-SSZ-13. Catalysis Science and Technology, 12 (11), 3516–3523. doi:10.1039/D2CY00021K  

Popov, I.; Bügel, P.; Kozlowska, M.; Fink, K.; Studt, F.; Sharapa, D. I. (2022). Analytical Model of CVD Growth of Graphene on Cu(111) Surface. Nanomaterials, 12 (17), Art.Nr. 2963. doi:10.3390/nano12172963  

Prestigiacomo, C.; Zimmermann, J.; Hornung, U.; Raffelt, K.; Dahmen, N.; Scialdone, O.; Galia, A. (2022). Effect of transition metals and homogeneous hydrogen producers in the hydrothermal liquefaction of sewage sludge. Fuel Processing Technology, 237, Art.-Nr.: 107452. doi:10.1016/j.fuproc.2022.107452  

Qin, S.; Denisov, N.; Sarma, B. B.; Hwang, I.; Doronkin, D. E.; Tomanec, O.; Kment, S.; Schmuki, P. (2022). Pt Single Atoms on TiO 2 Polymorphs—Minimum Loading with a Maximized Photocatalytic Efficiency. Advanced Materials Interfaces, 9 (22), Art.-Nr.: 2200808. doi:10.1002/admi.202200808  

Rüde, T.; Lu, Y.; Anschütz, L.; Blasius, M.; Wolf, M.; Preuster, P.; Wasserscheid, P.; Geißelbrecht, M. (2022). Performance of Continuous Hydrogen Production from Perhydro Benzyltoluene by Catalytic Distillation and Heat Integration Concepts with a Fuel Cell. Energy Technology, 11 (3), Art.-Nr.: 2201366. doi:10.1002/ente.202201366  

Santos, T. M.; Silva, W. R. da; Carregosa, J. de C.; Schmitt, C. C.; Moreira, R.; Raffelt, K.; Dahmen, N.; Wisniewski, A., Jr. (2022). Thermal Conversion of Sugarcane Bagasse Coupled with Vapor Phase Hydrotreatment over Nickel-Based Catalysts: A Comprehensive Characterization of Upgraded Products. Catalysts, 12 (4), 355. doi:10.3390/catal12040355  

Sarmah, N.; Sharma, D.; Mehta, B. K.; Shrivastava, B. D.; Das, B. K.; Zimina, A.; Gaur, A. (2022). Probing the electronic nature of Co centers forming the planar ring in octa-nuclear Co complexes using X-ray absorption spectroscopy. Journal of Molecular Structure, 1263, Art.-Nr.: 133125. doi:10.1016/j.molstruc.2022.133125  

Sayegh, A.; Merkert, S.; Zimmermann, J.; Horn, H.; Saravia, F. (2022). Treatment of Hydrothermal-Liquefaction Wastewater with Crossflow UF for Oil and Particle Removal. Membranes, 12 (3), Art.-Nr.: 255. doi:10.3390/membranes12030255  

Schulte, M.; Weber, S.; Klag, L.; Grunwaldt, J.-D.; Sheppard, T. L. (2022). Synchrotron PXRD deconvolutes nickel particle and support changes in Ni/ZrO methanation catalysts. Catalysis Science & Technology, 12 (20), 6069–6083. doi:10.1039/D2CY00972B  

Schumann, M.; Grunwaldt, J.-D.; Jensen, A. D.; Christensen, J. M. (2022). Investigations of mechanism, surface species and support effects in CO hydrogenation over Rh. Journal of Catalysis, 414, 90–100. doi:10.1016/j.jcat.2022.08.031  

Seid, N.; Griesheimer, P.; Neumann, A. (2022). Investigating the Processing Potential of Ethiopian Agricultural Residue Enset/Ensete ventricosum for Biobutanol Production. Bioengineering, 9 (4), Art.-Nr.: 133. doi:10.3390/bioengineering9040133  

Seitz, L. C.; Doronkin, D. E.; Hauschild, D.; Casapu, M.; Zengel, D.; Zimina, A.; Kreikemeyer-Lorenzo, D.; Blum, M.; Yang, W.; Grunwaldt, J.-D.; Heske, C.; Weinhardt, L. (2022). Direct Observation of Reactant, Intermediate, and Product Species for Nitrogen Oxide-Selective Catalytic Reduction on Cu-SSZ-13 Using In Situ Soft X-ray Spectroscopy. The Journal of Physical Chemistry C, 126 (49), 20998–21009. doi:10.1021/acs.jpcc.2c04736  

Semmel, M.; Steiner, L.; Bontrup, M.; Sauer, J.; Salem, O. (2022). Catalyst screening and reaction kinetics of liquid phase DME synthesis under reactive distillation conditions. Chemical Engineering Journal, 455, Art.Nr. 140525. doi:10.1016/j.cej.2022.140525  

Şen, A. U.; Fonseca, F. G.; Funke, A.; Pereira, H.; Lemos, F. (2022). Pyrolysis kinetics and estimation of chemical composition of Quercus cerris cork. Biomass Conversion and Biorefinery, 12, 4835–4845. doi:10.1007/s13399-020-00964-y 

Soares Dias, A. P.; Gomes Fonseca, F.; Catarino, M.; Gomes, J. (2022). Biodiesel Glycerin Valorization into Oxygenated Fuel Additives. Catalysis Letters, 152, 513–522. doi:10.1007/s10562-021-03646-0 

Stehle, M.; Gaur, A.; Weber, S.; Sheppard, T. L.; Thomann, M.; Fischer, A.; Grunwaldt, J.-D. (2022). Complementary operando insights into the activation of multicomponent selective propylene oxidation catalysts. Journal of catalysis, 408, 339–355. doi:10.1016/j.jcat.2021.08.053  

Su, Y.; Guo, B.; Hornung, U.; Dahmen, N. (2022). FeCl₃-supported solvothermal liquefaction of Miscanthus in methanol. Energy, 258, Art.-Nr.: 124971. doi:10.1016/j.energy.2022.124971  

Sun, X.; Yu, J.; Cao, S.; Zimina, A.; Sarma, B. B.; Grunwaldt, J.-D.; Xu, H.; Li, S.; Liu, Y.; Sun, J. (2022). In Situ Investigations on Structural Evolutions during the Facile Synthesis of Cubic α-MoC Catalysts. Journal of the American Chemical Society, 144 (49), 22589–22598. doi:10.1021/jacs.2c08979  

Tikhonov, D. S.; Scutelnic, V.; Sharapa, D. I.; Krotova, A. A.; Dmitrieva, A. V.; Obenchain, D. A.; Schnell, M. (2022). Structures of the (Imidazole)nH+ . Ar (n=1,2,3) complexes determined from IR spectroscopy and quantum chemical calculations. Structural Chemistry, 34 (1), 203–213. doi:10.1007/s11224-022-02053-4  

Tofighi, G.; Lichtenberg, H.; Gaur, A.; Wang, W.; Wild, S.; Herrera Delgado, K.; Pitter, S.; Dittmeyer, R.; Grunwaldt, J.-D.; Doronkin, D. E. (2022). Continuous Synthesis of Cu/ZnO/Al2O3 Nanoparticles in a Co-precipitation Reaction Using a Silicon Based Microfluidic Reactor. Reaction chemistry & engineering, 7 (3), 730–740. doi:10.1039/D1RE00499A  

Treu, P.; Huber, P.; Plessow, P. N.; Studt, F.; Saraçi, E. (2022). Lewis acid Sn-Beta catalysts for the cycloaddition of isoprene and methyl acrylate: a greener route to bio-derived monomers. Catalysis Science & Technology, 12 (24), 7439–7447. doi:10.1039/D2CY01337A  

Treu, P.; Sarma, B. B.; Grunwaldt, J.-D.; Saraçi, E. (2022). Oxidative cleavage of vicinal diols catalyzed by monomeric Fe‐sites inside MFI zeolite. ChemCatChem, 14 (21), e202200993. doi:10.1002/cctc.202200993  

Trinkies, L. L.; Düll, A.; Zhang, J.; Urban, S.; Deschner, B. J.; Kraut, M.; Ladewig, B. P.; Weltin, A.; Kieninger, J.; Dittmeyer, R. (2022). Investigation of mass transport processes in a microstructured membrane reactor for the direct synthesis of hydrogen peroxide. Chemical engineering science, 248, Ar. Nr.: 117145. doi:10.1016/j.ces.2021.117145  

Uzunidis, G.; Behrens, S. (2022). Pd/Ag Nanoparticles Prepared in Ionic Liquids as Model Catalysts for the Hydrogenation of Diphenylacetylene . Chemie - Ingenieur - Technik, 94 (3), 328–339. doi:10.1002/cite.202100163  

Virt, M.; Arnold, U. (2022). Effects of Oxymethylene Ether in a Commercial Diesel Engine. Cognitive Sustainability, 1 (3). doi:10.55343/cogsust.20  

Visser, N. L.; Daoura, O.; Plessow, P. N.; Smulders, L. C. J.; Rijk, J. W. de; de Rijk, J. W.; Stewart, J. A.; Vandegehuchte, B. D.; Studt, F.; van der Hoeven, J. E. S. (2022). Particle Size Effects of Carbon Supported Nickel Nanoparticles for High Pressure CO 2 Methanation. ChemCatChem, 14 (22), Art.Nr. e202200665. doi:10.1002/cctc.202200665 

Wan, S.; Keller, K.; Lott, P.; Shirsath, A. B.; Tischer, S.; Häber, T.; Suntz, R.; Deutschmann, O. (2022). Experimental and numerical investigation of NO oxidation on Pt/Al₂ O₃- and NOₓ storage on Pt/BaO/Al₂ O₃-catalysts. Catalysis Science & Technology, 12 (14), 4456–4470. doi:10.1039/d2cy00572g  

Wang, J.; Sauter, E.; Nefedov, A.; Heißler, S.; Maurer, F.; Casapu, M.; Grunwaldt, J.-D.; Wang, Y.; Wöll, C. (2022). Dynamic Structural Evolution of Ceria-Supported Pt Particles: A Thorough Spectroscopic Study. The Journal of Physical Chemistry C, 126 (21), 9051–9058. doi:10.1021/acs.jpcc.2c02420  

Wang, S.; Rohlfs, P.; Börnhorst, M.; Schillaci, A.; Marschall, H.; Deutschmann, O.; Wörner, M. (2022). Bubble Cutting by Cylinder – Elimination of Wettability Effects by a Separating Liquid Film. Chemie-Ingenieur-Technik, 94 (3), 385–392. doi:10.1002/cite.202100145  

Weber, S.; Diaz, A.; Holler, M.; Schropp, A.; Lyubomirskiy, M.; Abel, K. L.; Kahnt, M.; Jeromin, A.; Kulkarni, S.; Keller, T. F.; Gläser, R.; Sheppard, T. L. (2022). Evolution of Hierarchically Porous Nickel Alumina Catalysts Studied by X‐Ray Ptychography. Advanced science, 9 (8), 2105432. doi:10.1002/advs.202105432  

Weber, S.; Zimmermann, R. T.; Bremer, J.; Abel, K. L.; Poppitz, D.; Prinz, N.; Ilsemann, J.; Wendholt, S.; Yang, Q.; Pashminehazar, R.; Monaco, F.; Cloetens, P.; Huang, X.; Kübel, C.; Kondratenko, E.; Bauer, M.; Bäumer, M.; Zobel, M.; Gläser, R.; Sundmacher, K.; Sheppard, T. L. (2022). Digitization in Catalysis Research: Towards a Holistic Description of a Ni/Al2O3 Reference Catalyst for CO2 Methanation. ChemCatChem, 14 (8), e202101878. doi:10.1002/cctc.202101878  

Weyhing, T.; Koch, T.; Wagner, U.; Dahmen, N. (2022). G40 - Ein Schritt zu einem CO-neutralen Benzinkraftstoff. MTZ - Motortechnische Zeitschrift, 83 (9), 30–36. doi:10.1007/s35146-022-0852-4  

Wild, S.; Lacerda de Oliveira Campos, B.; Zevaco, T. A.; Guse, D.; Kind, M.; Pitter, S.; Herrera Delgado, K.; Sauer, J. (2022). Experimental investigations and model-based optimization of CZZ/H-FER 20 bed compositions for the direct synthesis of DME from CO-rich syngas. Reaction chemistry & engineering, 7 (4), 943–956. doi:10.1039/d1re00470k  

Wollak, B.; Doronkin, D. E.; Espinoza, D.; Sheppard, T.; Korup, O.; Schmidt, M.; Alizadefanaloo, S.; Rosowski, F.; Schroer, C.; Grunwaldt, J.-D.; Horn, R. (2022). Exploring Catalyst Dynamics in a Fixed Bed Reactor by Correlative Operando Spatially-Resolved Structure-Activity Profiling. Journal of catalysis, 408, 372–387. doi:10.1016/j.jcat.2021.08.029  

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 and soot abatement. Catalysis Science & Technology, 12 (12), 3969–3981. doi:10.1039/d2cy00432a  

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  

Fuchs, C.; Arnold, U.; Sauer, J. (2022). Synthesis of sustainable, free of aromatics fuels by heterogeneously catalyzed oligomerization of renewable C-C olefins. Proceedings of Abstracts 13th International Conference on Air Quality: Science and Application. Ed.: R. Sokhi, 157, University of Hertfordshire. 

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. 

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, Hrsg.), Verbundvorhaben NAMOSYN. 

Arnold, U.; Drexler, M.; Fuchs, C.; Niethammer, B.; Sauer, J. (2022, Dezember 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, 24.–28. Januar 2022. 

Bagheri, M.; Dadvand, A.; Wörner, M.; Marschall, H. (2022, Juli 14). A Unified Finite Volume Framework for Phase-field Simulations of Arbitraty Number of Immiscible Incompressible Fluids. 17th OpenFOAM Workshop (OFW 2022), Cambridge, Vereinigtes Königreich, 11.–14. Juli 2022.  

Bagheri, M.; Wörner, M.; Marschall, H. (2022, März 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, Deutschland, 16.–18. März 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), Venedig, Italien, 28.–30. September 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), Brüssel, Belgien, 29.–31. August 2022. 

Behrendt, G.; Mockenhaupt, B.; Pandit, L.; Boubnov, A.; Saraçi, E.; Chowdhury, C.; Jelić, J.; Studt, F.; Grunwaldt, J.-D.; Behrens, M. (2022, Juni 28). Dynamics of SMSI in Cu/ZnO catalysts for methanol synthesis: Spectroscopic and theoretical insight from inverse catalysts. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Deutschland, 27.–29. Juni 2022. 

Börnhorst, M.; Homan, T.; Rohlfs, P.; Deen, N. G.; Wörner, M. (2022, Februar 22). Charakterisierung der Zerteilungsdynamik von Blasen an Zylindern. Jahrestreffen der ProcessNet-Fachgruppen Mehrphasenströmungen, Mechanische Flüssigkeitsabtrennung sowie Zerkleinern und Klassieren (2022), Online, 21.–22. Februar 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, Juni 29). Noble metal particle size and support morphology effects on emission control by mono and bimetallic catalysts. 55. Jahrestreffen Deutscher Katalytiker (2022), Weimar, Deutschland, 27.–29. Juni 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, Mai 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 City, NY, USA, 22.–27. Mai 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, Deutschland, 11.–13. September 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, Deutschland, 5.–7. September 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), Brüssel, Belgien, 29.–31. August 2022. 

Doronkin, D. (2022, Januar 20). Operando XAS Probing Pd Catalysts in HIgh Pressure Chemical Reactors. GlobalXAS Journal Club (2022), Online, 20. Januar 2022. 

Doronkin, D.; Deschner, B. J.; Wang, S.; Dittmeyer, R.; Behrens, S.; Grunwaldt, J.-D. (2022, Juni 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, Finnland, 6.–8. Juni 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), Brüssel, Belgien, 29.–31. August 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, 16.–20. Oktober 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, Deutschland, 12.–15. September 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, Deutschland, 10.–12. Mai 2022. 

Grunwaldt, J.-D. (2022, März 22). Catalysis for a clean and sustainable future: Dynamics on different time and complexity scales. European XFEL Science Seminar (2022), Hamburg, Deutschland, 22. März 2022. 

Grunwaldt, J.-D. (2022, Januar). Research with Photons – Light for the Future, Committee “Research with Synchrotron Radiation”. European XFEL Users’ Meeting / DESY Photon Science Users’ Meeting (2022), Online, 21.–28. Januar 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, Deutschland, 21. April 2022. 

Keller, K.; Lott, P.; Casapu, M.; Grunwaldt, J.-D.; Deutschmann, O. (2022, Mai 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 City, NY, USA, 22.–27. Mai 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), Lissabon, Portugal, 28. August–1. September 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, Vereinigtes Königreich, 4.–8. September 2022. 

Kuhn, C.; Rohlfs, P.; Düll, A.; Tischer, S.; Börnhorst, M.; Deutschmann, O. (2022, Juli 20). Iron as recyclable metal fuel: Reaction kinetic analysis of iron oxide reduction with hydrogen. Jahrestreffen Reaktionstechnik (2022), Würzburg, Deutschland, 18.–20. Juli 2022. 

Lacerda de Oliveira Campos, B.; Herfet, M.; Rodrigues Niquini, G.; Wild, S.; Herrera Delgado, K.; Pitter, S.; Sauer, J. (2022, Juni 6). Multi-Scale Modeling of Methanol and Direct Dimethyl Ether Synthesis from CO2-rich Syngas. 19th Nordic Symposium on Catalysis (NSC 2022), Espoo, Finnland, 6.–8. Juni 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, Deutschland, 5.–7. September 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, Januar 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, 21.–28. Januar 2022. 

Neukum, D.; Baumgarten, L.; Wüst, D.; Saraçi, E.; Kruse, A.; Grunwaldt, J.-D. (2022, Juni 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, Finnland, 6.–8. Juni 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), Prag, Tschechien, 21.–25. August 2022. 

Pitter, S.; De Campos, L.; Guse, D.; Delgado, K. H.; Polierer, S.; Sauer, J.; Warmuth, L.; Wild, S.; Kind, M. (2022, Juni 7). Scalable synthesis of Cu-based catalysts as a tool for accelerated process development. 19th Nordic Symposium on Catalysis (NSC 2022), Espoo, Finnland, 6.–8. Juni 2022. 

Sarma, B. B. (2022, Mai). Understanding Dynamics of Supported Atoms and Clusters with In-Situ/Operando Spectroscopy. 1st Conference of Applied Surface Chemistry (COAST 2022), Wiener Neustadt, Österreich, 16.–17. Mai 2022. 

Serrer, M.-A.; Zimina, A.; Saraҫi E.; Loewert, M.; Pfeifer, P.; Grunwaldt, J.-D. (2022, März 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, 28. März–1. April 2022. 

Sheppard, T.; Becher, J.; Sanchez, D. F.; Doronkin, D.; Grunwaldt, J.-D. (2022, März 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, 28. März–1. April 2022. 

Treu, P.; Huber, P.; Plessow, P. N.; Studt, F.; Saraçi, E. (2022, März 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, Deutschland, 23.–25. März 2022. 

Treu, P.; Saraçi, E.; Sarma, B. B.; Grunwaldt, J.-D. (2022, Juni 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, Finnland, 6.–8. Juni 2022.