Toward an Understanding of Selective Alkyne Hydrogenation on Ceria: On the Impact of O Vacancies on H2 Interaction with CeO2(111) K Werner, X Weng, F Calaza, M Sterrer, T Kropp, J Paier, J Sauer, ... Journal of the American Chemical Society 139 (48), 17608-17616, 2017 | 136 | 2017 |
O2 Activation on Ceria Catalysts—The Importance of Substrate Crystallographic Orientation C Yang, X Yu, S Heißler, PG Weidler, A Nefedov, Y Wang, C Wöll, ... Angewandte Chemie International Edition 56 (51), 16399-16404, 2017 | 112 | 2017 |
Support effect in oxide catalysis: methanol oxidation on vanadia/ceria T Kropp, J Paier, J Sauer Journal of the American Chemical Society 136 (41), 14616-14625, 2014 | 110 | 2014 |
Transition Metal Atoms Embedded in Graphene: How Nitrogen Doping Increases CO Oxidation Activity T Kropp, M Mavrikakis ACS Catalysis 9 (8), 6864-6868, 2019 | 81 | 2019 |
Correlation Between Reactivity and Oxidation State of Cobalt Oxide Catalysts for CO Preferential Oxidation L Zhong, T Kropp, W Baaziz, O Ersen, D Teschner, R Schlögl, ... ACS Catalysis 9 (9), 8325-8336, 2019 | 65 | 2019 |
Anionic single-atom catalysts for CO oxidation: support-independent activity at low temperatures T Kropp, Z Lu, Z Li, YHC Chin, M Mavrikakis Acs Catalysis 9 (2), 1595-1604, 2019 | 60 | 2019 |
How noninnocent spectator species improve the oxygen reduction activity of single-atom catalysts: microkinetic models from first-principles calculations M Rebarchik, S Bhandari, T Kropp, M Mavrikakis ACS Catalysis 10 (16), 9129-9135, 2020 | 47 | 2020 |
Interactions of water with the (111) and (100) surfaces of ceria T Kropp, J Paier, J Sauer The Journal of Physical Chemistry C 121 (39), 21571-21578, 2017 | 42 | 2017 |
Methanol adsorption on monocrystalline ceria surfaces C Yang, F Bebensee, A Nefedov, C Wöll, T Kropp, L Komissarov, ... Journal of catalysis 336, 116-125, 2016 | 41 | 2016 |
Brønsted–Evans–Polanyi relation for CO oxidation on metal oxides following the Mars–van Krevelen mechanism T Kropp, M Mavrikakis Journal of Catalysis 377, 577-581, 2019 | 40 | 2019 |
Reactions of methanol with pristine and defective ceria (111) surfaces: A comparison of density functionals T Kropp, J Paier The Journal of Physical Chemistry C 118 (41), 23690-23700, 2014 | 40 | 2014 |
Activity versus selectivity of the methanol oxidation at ceria surfaces: a comparative first-principles study T Kropp, J Paier The Journal of Physical Chemistry C 119 (40), 23021-23031, 2015 | 36 | 2015 |
Oxidative dehydrogenation of methanol at ceria-supported vanadia oligomers T Kropp, J Paier, J Sauer Journal of catalysis 352, 382-387, 2017 | 33 | 2017 |
Stability and migration barriers of small vanadium oxide clusters on the CeO 2 (111) surface studied by density functional theory J Paier, T Kropp, C Penschke, J Sauer Faraday discussions 162, 233-245, 2013 | 30 | 2013 |
A self-adjusting platinum surface for acetone hydrogenation B Demir, T Kropp, KR Rivera-Dones, EB Gilcher, GW Huber, M Mavrikakis, ... Proceedings of the National Academy of Sciences 117 (7), 3446-3450, 2020 | 22 | 2020 |
Ir-Ni bimetallic OER catalysts prepared by controlled Ni electrodeposition on Irpoly and Ir (111) E Özer, I Sinev, AM Mingers, J Araujo, T Kropp, M Mavrikakis, ... Surfaces 1 (1), 165-186, 2018 | 20 | 2018 |
Effect of strain on the reactivity of graphene films T Kropp, M Mavrikakis Journal of Catalysis 390, 67-71, 2020 | 16 | 2020 |
Effects of water on the kinetics of acetone hydrogenation over Pt and Ru catalysts B Demir, T Kropp, EB Gilcher, M Mavrikakis, JA Dumesic Journal of Catalysis 403, 215-227, 2021 | 15 | 2021 |
O2‐Aktivierung an Cerdioxid‐Katalysatoren–Zur Bedeutung der kristallographischen Orientierung des Substrats C Yang, X Yu, S Heißler, PG Weidler, A Nefedov, Y Wang, C Wöll, ... Angewandte Chemie 129 (51), 16618-16623, 2017 | 12 | 2017 |
On the active site for electrocatalytic water splitting on late transition metals embedded in graphene T Kropp, M Rebarchik, M Mavrikakis Catalysis Science & Technology 9 (23), 6793-6799, 2019 | 11 | 2019 |