Ab initio study of CO2 hydrogenation mechanisms on inverse ZnO/Cu catalysts

Research output: Contribution to journal/Conference contribution in journal/Contribution to newspaperJournal article

    Thomas Reichenbach, Univ Freiburg, University of Freiburg, Freiburger Mat Forschungszentrum, Krishnakanta Mondal, Univ Freiburg, University of Freiburg, Freiburger Mat Forschungszentrum, Marc Jaeger, Univ Freiburg, University of Freiburg, Inst Anorgan & Analyt Chem, Thomas Vent-Schmidt, Univ Freiburg, University of Freiburg, Inst Anorgan & Analyt Chem, Daniel Himmel, Univ Freiburg, University of Freiburg, Inst Anorgan & Analyt Chem, Valentin Dybbert, Univ Freiburg, University of Freiburg, Inst Anorgan & Analyt Chem, Albert Bruix, Ingo Krossing, Univ Freiburg, University of Freiburg, Inst Anorgan & Analyt Chem, Michael Walter, Univ Freiburg, University of Freiburg, Phys Inst, Michael Moseler, Univ Freiburg, University of Freiburg, Phys Inst
Original languageEnglish
JournalJournal of Catalysis
Volume360
Pages (from-to)168-174
Number of pages7
ISSN0021-9517
DOIs
StatePublished - Apr 2018

    Research areas

  • Inverse catalyst, methanol, CO2, Renewable energy, hydrogenation, DFT, Coupled cluster, TRANSITION-METAL SURFACES, DENSITY-FUNCTIONAL THEORY, METHANOL SYNTHESIS, CU/ZNO CATALYSTS, INTERACTION ENERGIES, SUPPORT INTERACTIONS, BENCHMARK DATABASE, CARBON-DIOXIDE, IONIC LIQUIDS, CONVERSION

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