| Water oxidation on a mononuclear manganese heterogeneous catalyst J Guan, Z Duan, F Zhang, SD Kelly, R Si, M Dupuis, Q Huang, JQ Chen, ... Nature Catalysis 1 (11), 870-877, 2018 | 286 | 2018 |
| A first principles study of oxygen reduction reaction on a Pt (111) surface modified by a subsurface transition metal M (M= Ni, Co, or Fe) Z Duan, G Wang Physical Chemistry Chemical Physics 13 (45), 20178-20187, 2011 | 278 | 2011 |
| Comparison of reaction energetics for oxygen reduction reactions on Pt (100), Pt (111), Pt/Ni (100), and Pt/Ni (111) surfaces: a first-principles study Z Duan, G Wang The Journal of Physical Chemistry C 117 (12), 6284-6292, 2013 | 194 | 2013 |
| Rational development of ternary alloy electrocatalysts C Wang, D Li, M Chi, J Pearson, RB Rankin, J Greeley, Z Duan, G Wang, ... The journal of physical chemistry letters 3 (12), 1668-1673, 2012 | 159 | 2012 |
| Oxygen reduction reaction on classically immiscible bimetallics: a case study of RhAu H Li, L Luo, P Kunal, CS Bonifacio, Z Duan, JC Yang, SM Humphrey, ... The Journal of Physical Chemistry C 122 (5), 2712-2716, 2018 | 134 | 2018 |
| Atomically dispersed manganese-based catalysts for efficient catalysis of oxygen reduction reaction L Bai, Z Duan, X Wen, R Si, J Guan Applied Catalysis B: Environmental 257, 117930, 2019 | 131 | 2019 |
| Theoretical resolution of the exceptional oxygen reduction activity of Au (100) in alkaline media Z Duan, G Henkelman ACS Catalysis 9 (6), 5567-5573, 2019 | 130 | 2019 |
| Highly dispersed ruthenium-based multifunctional electrocatalyst L Bai, Z Duan, X Wen, R Si, Q Zhang, J Guan ACS Catalysis 9 (11), 9897-9904, 2019 | 121 | 2019 |
| CO Oxidation at the Au/TiO2 Boundary: The Role of the Au/Ti5c Site Z Duan, G Henkelman ACS Catalysis 5 (3), 1589-1595, 2015 | 118 | 2015 |
| Detection of CO2•– in the Electrochemical Reduction of Carbon Dioxide in N,N-Dimethylformamide by Scanning Electrochemical Microscopy T Kai, M Zhou, Z Duan, GA Henkelman, AJ Bard Journal of the American Chemical Society 139 (51), 18552-18557, 2017 | 116 | 2017 |
| Tunability of the adsorbate binding on bimetallic alloy nanoparticles for the optimization of catalytic hydrogenation L Luo, Z Duan, H Li, J Kim, G Henkelman, RM Crooks Journal of the American Chemical Society 139 (15), 5538-5546, 2017 | 116 | 2017 |
| Well-defined nanoparticle electrocatalysts for the refinement of theory JA Trindell, Z Duan, G Henkelman, RM Crooks Chemical reviews 120 (2), 814-850, 2019 | 95 | 2019 |
| Identification of active sites of pure and nitrogen-doped carbon materials for oxygen reduction reaction using constant-potential calculations Z Duan, G Henkelman The Journal of Physical Chemistry C 124 (22), 12016-12023, 2020 | 84 | 2020 |
| Atomic cobalt catalysts for the oxygen evolution reaction Q Zhang, Z Duan, M Li, J Guan Chemical Communications 56 (5), 794-797, 2020 | 83 | 2020 |
| Formation of HONO from the NH3-promoted hydrolysis of NO2 dimers in the atmosphere L Li, Z Duan, H Li, C Zhu, G Henkelman, JS Francisco, XC Zeng Proceedings of the National Academy of Sciences 115 (28), 7236-7241, 2018 | 79 | 2018 |
| Surface Charge and Electrostatic Spin Crossover Effects in CoN4 Electrocatalysts Z Duan, G Henkelman ACS Catalysis 10 (20), 12148-12155, 2020 | 77 | 2020 |
| CO oxidation on the Pd (111) surface Z Duan, G Henkelman Acs Catalysis 4 (10), 3435-3443, 2014 | 77 | 2014 |
| Unveiling the active sites of ultrathin Co-Fe layered double hydroxides for the oxygen evolution reaction X Bai, Z Duan, B Nan, L Wang, T Tang, J Guan Chinese Journal of Catalysis 43 (8), 2240-2248, 2022 | 73 | 2022 |
| Calculations of CO Oxidation over a Au/TiO2 Catalyst: A Study of Active Sites, Catalyst Deactivation, and Moisture Effects Z Duan, G Henkelman ACS Catalysis 8 (2), 1376-1383, 2018 | 73 | 2018 |
| Density Functional Theory Study of an Oxygen Reduction Reaction on a Pt3Ti Alloy Electrocatalyst S Kattel, Z Duan, G Wang The Journal of Physical Chemistry C 117 (14), 7107-7113, 2013 | 70 | 2013 |
Graeme HenkelmanProfessor of Chemistry, University of Texas在 utexas.edu 的电子邮件经过验证
