Toward Computing Accurate Free Energies in Heterogeneous Catalysis: a Case Study for Adsorbed Isobutene in H-ZSM-5

por De Wispelaere, Kristof, Plessow, Philipp N., Studt, Felix
Publicado 2022

Fundamental concepts in heterogeneous catalysis

por Norskov, Jens K, Studt, Felix, Abild-Pedersen, Frank, Bligaard, Thomas
Publicado 2014

Multiscale Model of CVD Growth of Graphene on Cu(111) Surface

por Esmaeilpour, Meysam, Bügel, Patrick, Fink, Karin, Studt, Felix, Wenzel, Wolfgang, Kozlowska, Mariana
Publicado 2023

Efficient noble metal promoted bimetallic cobalt catalysts in the selective synthesis of acetaldehyde dimethyl acetal

por Sheikh, Kalim A., Zevaco, Thomas A., Jelic, Jelena, Studt, Felix, Bender, Michael
Publicado 2023

Analytical Model of CVD Growth of Graphene on Cu(111) Surface

por Popov, Ilya, Bügel, Patrick, Kozlowska, Mariana, Fink, Karin, Studt, Felix, Sharapa, Dmitry I.
Publicado 2022

Metal–Support Interactions in Heterogeneous Catalysis: DFT Calculations on the Interaction of Copper Nanoparticles with Magnesium Oxide

por Hakimioun, Amir H., Vandegehuchte, Bart D., Curulla-Ferre, Daniel, Kaźmierczak, Kamila, Plessow, Philipp N., Studt, Felix
Publicado 2023

Mechanistic differences between methanol and dimethyl ether in zeolite-catalyzed hydrocarbon synthesis

por Kirchberger, Felix M., Liu, Yue, Plessow, Philipp N., Tonigold, Markus, Studt, Felix, Sanchez-Sanchez, Maricruz, Lercher, Johannes A.
Publicado 2022

Interplay of Electronic and Steric Effects to Yield Low‐Temperature CO Oxidation at Metal Single Sites in Defect‐Engineered HKUST‐1

por Wang, Weijia, Sharapa, Dmitry I., Chandresh, Abhinav, Nefedov, Alexei, Heißler, Stefan, Heinke, Lars, Studt, Felix, Wang, Yuemin, Wöll, Christof
Publicado 2020

Rhodium Single‐Atom Catalyst Design through Oxide Support Modulation for Selective Gas‐Phase Ethylene Hydroformylation

por Farpón, Marcos G., Henao, Wilson, Plessow, Philipp N., Andrés, Eva, Arenal, Raúl, Marini, Carlo, Agostini, Giovanni, Studt, Felix, Prieto, Gonzalo
Publicado 2022

Understanding activity trends in electrochemical water oxidation to form hydrogen peroxide

por Shi, Xinjian, Siahrostami, Samira, Li, Guo-Ling, Zhang, Yirui, Chakthranont, Pongkarn, Studt, Felix, Jaramillo, Thomas F., Zheng, Xiaolin, Nørskov, Jens K.
Publicado 2017

Supported Intermetallic PdZn Nanoparticles as Bifunctional Catalysts for the Direct Synthesis of Dimethyl Ether from CO‐Rich Synthesis Gas

por Gentzen, Manuel, Doronkin, Dmitry E., Sheppard, Thomas L., Zimina, Anna, Li, Haisheng, Jelic, Jelena, Studt, Felix, Grunwaldt, Jan‐Dierk, Sauer, Jörg, Behrens, Silke
Publicado 2019

One‐Pot Cooperation of Single‐Atom Rh and Ru Solid Catalysts for a Selective Tandem Olefin Isomerization‐Hydrosilylation Process

por Sarma, Bidyut B., Kim, Jonglack, Amsler, Jonas, Agostini, Giovanni, Weidenthaler, Claudia, Pfänder, Norbert, Arenal, Raul, Concepción, Patricia, Plessow, Philipp, Studt, Felix, Prieto, Gonzalo
Publicado 2020

Shape-Dependent CO(2) Hydrogenation to Methanol over Cu(2)O Nanocubes Supported on ZnO

por Kordus, David, Jelic, Jelena, Lopez Luna, Mauricio, Divins, Núria J., Timoshenko, Janis, Chee, See Wee, Rettenmaier, Clara, Kröhnert, Jutta, Kühl, Stefanie, Trunschke, Annette, Schlögl, Robert, Studt, Felix, Roldan Cuenya, Beatriz
Publicado 2023