| Effect of collective dynamics and anharmonicity on entropy in heterogenous catalysis: Building the case for advanced molecular simulations G Collinge, SF Yuk, MT Nguyen, MS Lee, VA Glezakou, R Rousseau ACS Catalysis 10 (16), 9236-9260, 2020 | 92 | 2020 |
| Ab initio molecular dynamics with enhanced sampling in heterogeneous catalysis GM Piccini, MS Lee, SF Yuk, D Zhang, G Collinge, L Kollias, MT Nguyen, ... Catalysis Science & Technology 12 (1), 12-37, 2022 | 64 | 2022 |
| Surface density dependent catalytic activity of single palladium atoms supported on ceria Y Kim, G Collinge, MS Lee, K Khivantsev, SJ Cho, VA Glezakou, ... Angewandte Chemie International Edition 60 (42), 22769-22775, 2021 | 42 | 2021 |
| Coverage-dependent adsorption of hydrogen on Fe (100): Determining catalytically relevant surface structures via lattice gas models AJR Hensley, G Collinge, Y Wang, JS McEwen The Journal of Physical Chemistry C 124 (13), 7254-7266, 2020 | 36 | 2020 |
| CO-induced inversion of the layer sequence of a model CoCu catalyst G Collinge, Y Xiang, R Barbosa, JS McEwen, N Kruse Surface Science 648, 74-83, 2016 | 33 | 2016 |
| Role of carbon monoxide in catalyst reconstruction for CO hydrogenation: first-principles study of the composition, structure, and stability of Cu/Co (1012) as a function of CO … G Collinge, N Kruse, JS McEwen The Journal of Physical Chemistry C 121 (4), 2181-2191, 2017 | 26 | 2017 |
| Coverage-Dependent Adsorption of Phenol on Pt (111) from First Principles N Chaudhary, A Hensley, G Collinge, Y Wang, JS McEwen The Journal of Physical Chemistry C 124 (1), 356-362, 2019 | 22 | 2019 |
| Activation of lattice and adatom oxygen by highly stable ceria-supported Cu single atoms CE García-Vargas, G Collinge, D Yun, MS Lee, V Muravev, YQ Su, ... ACS Catalysis 12 (21), 13649-13662, 2022 | 21 | 2022 |
| Formulation of multicomponent lattice gas model cluster expansions parameterized on ab initio data: An introduction to the ab initio mean-field augmented lattice gas modeling code G Collinge, K Groden, C Stampfl, JS McEwen The Journal of Physical Chemistry C 124 (5), 2923-2938, 2019 | 21 | 2019 |
| Predicting the electric field effect on the lateral interactions between adsorbates: O/Fe (100) from first principles J Bray, G Collinge, C Stampfl, Y Wang, JS McEwen Topics in Catalysis 61, 763-775, 2018 | 21 | 2018 |
| Benchmarking the accuracy of coverage-dependent models: adsorption and desorption of benzene on Pt (1 1 1) and Pt3Sn (1 1 1) from first principles BM Wong, G Collinge, AJR Hensley, Y Wang, JS McEwen Progress in Surface Science 94 (2), 100538, 2019 | 18 | 2019 |
| Characterization of CoCu-and CoMn-based catalysts for the Fischer–Tropsch reaction toward chain-lengthened oxygenates JM Voss, Y Xiang, G Collinge, DE Perea, L Kovarik, JS McEwen, N Kruse Topics in Catalysis 61, 1016-1023, 2018 | 18 | 2018 |
| Dynamic copper site redispersion through atom trapping in zeolite defects SC Purdy, G Collinge, J Zhang, SN Borate, KA Unocic, Q Wu, ... Journal of the American Chemical Society 146 (12), 8280-8297, 2024 | 15 | 2024 |
| Creating self-assembled arrays of mono-oxo (MoO3)1 species on TiO2(101) via deposition and decomposition of (MoO3)n oligomers N Doudin, G Collinge, PK Gurunathan, MS Lee, VA Glezakou, ... Proceedings of the National Academy of Sciences 118 (4), e2017703118, 2021 | 15 | 2021 |
| Mechanistic understanding of catalytic conversion of ethanol to 1-butene over 2D-Pillared MFI zeolite SF Yuk, MS Lee, G Collinge, J Zhang, AB Padmaperuma, Z Li, ... The Journal of Physical Chemistry C 124 (52), 28437-28447, 2020 | 15 | 2020 |
| Selective acetylene hydrogenation over single metal atoms supported on Fe3O4 (001): A first-principle study SF Yuk, G Collinge, MT Nguyen, MS Lee, VA Glezakou, R Rousseau The Journal of Chemical Physics 152 (15), 2020 | 13 | 2020 |
| Modeling the adsorbate coverage distribution over a multi-faceted catalytic grain in the presence of an electric field: O/Fe from first principles J Bray, AJR Hensley, G Collinge, F Che, Y Wang, JS McEwen Catalysis Today 312, 92-104, 2018 | 13 | 2018 |
| Dissolution of CoCu catalyst step defects by Co subcarbonyl formation G Collinge, N Kruse, JS McEwen Journal of Catalysis 368, 31-37, 2018 | 12 | 2018 |
| Promoting the cleavage of C–O bonds at the interface between a metal oxide cluster and a Co (0001) support R Zhang, M Athariboroujeny, G Collinge, V Iablokov, KD Shumilov, ... ACS Catalysis 10 (24), 14722-14731, 2020 | 11 | 2020 |
| Dynamically formed active sites on liquid boron oxide for selective oxidative dehydrogenation of propane J Tian, G Collinge, SF Yuk, J Lin, VA Glezakou, MS Lee, Y Wang, ... ACS Catalysis 13 (12), 8219-8236, 2023 | 10 | 2023 |
Jean-Sabin McEwenWashington State UniversityVerificeret mail på wsu.edu
