| Oxygen evolution reaction over catalytic single-site Co in a well-defined brookite TiO2 nanorod surface C Liu, J Qian, Y Ye, H Zhou, CJ Sun, C Sheehan, Z Zhang, G Wan, YS Liu, ... Nature Catalysis 4 (1), 36-45, 2021 | 205 | 2021 |
| Reaction mechanism and kinetics for ammonia synthesis on the Fe (111) surface J Qian, Q An, A Fortunelli, RJ Nielsen, WA Goddard III Journal of the American Chemical Society 140 (20), 6288-6297, 2018 | 137 | 2018 |
| Dramatic differences in carbon dioxide adsorption and initial steps of reduction between silver and copper Y Ye, H Yang, J Qian, H Su, KJ Lee, T Cheng, H Xiao, J Yano, ... Nature communications 10 (1), 1875, 2019 | 72 | 2019 |
| Ternary alloys enable efficient production of methoxylated chemicals via selective electrocatalytic hydrogenation of lignin monomers T Peng, T Zhuang, Y Yan, J Qian, GR Dick, J Behaghel de Bueren, ... Journal of the American Chemical Society 143 (41), 17226-17235, 2021 | 45 | 2021 |
| Nucleation of amorphous shear bands at nanotwins in boron suboxide Q An, KM Reddy, J Qian, KJ Hemker, MW Chen, WA Goddard III Nature communications 7 (1), 11001, 2016 | 45 | 2016 |
| Gold-like activity copper-like selectivity of heteroatomic transition metal carbides for electrocatalytic carbon dioxide reduction reaction M Esmaeilirad, A Baskin, A Kondori, A Sanz-Matias, J Qian, B Song, ... Nature communications 12 (1), 5067, 2021 | 42 | 2021 |
| The Donnan potential revealed P Aydogan Gokturk, R Sujanani, J Qian, Y Wang, LE Katz, BD Freeman, ... Nature communications 13 (1), 5880, 2022 | 38 | 2022 |
| Initial Steps in Forming the Electrode–Electrolyte Interface: H2O Adsorption and Complex Formation on the Ag(111) Surface from Combining Quantum Mechanics … J Qian, Y Ye, H Yang, J Yano, EJ Crumlin, WA Goddard III Journal of the American Chemical Society 141 (17), 6946-6954, 2019 | 23 | 2019 |
| Synergy between a silver–copper surface alloy composition and carbon dioxide adsorption and activation Y Ye, J Qian, H Yang, H Su, KJ Lee, A Etxebarria, T Cheng, H Xiao, ... ACS applied materials & interfaces 12 (22), 25374-25382, 2020 | 21 | 2020 |
| Addressing the sensitivity of signals from solid/liquid ambient pressure XPS (APXPS) measurement J Qian, A Baskin, Z Liu, D Prendergast, EJ Crumlin The Journal of chemical physics 153 (4), 2020 | 19 | 2020 |
| Effect of Co doping on mechanism and kinetics of ammonia synthesis on Fe (1 1 1) surface J Qian, A Fortunelli, WA Goddard III Journal of catalysis 370, 364-371, 2019 | 15 | 2019 |
| Efficient basis sets for core-excited states motivated by Slater's rules J Qian, EJ Crumlin, D Prendergast Physical Chemistry Chemical Physics 24 (4), 2243-2250, 2022 | 8 | 2022 |
| The quantum mechanics derived atomistic mechanism underlying the acceleration of catalytic CO oxidation on Pt (110) by surface acoustic waves Q An, J Qian, RR Nielsen, L Sementa, G Barcaro, FR Negreiros, ... Journal of materials chemistry A 4 (31), 12036-12045, 2016 | 8 | 2016 |
| Chemical transformations and transport phenomena at interfaces H Hao, L Ruiz Pestana, J Qian, M Liu, Q Xu, T Head‐Gordon Wiley Interdisciplinary Reviews: Computational Molecular Science 13 (2), e1639, 2023 | 7 | 2023 |
| Understanding reaction networks through controlled approach to equilibrium experiments using transient methods Y Wang, J Qian, Z Fang, MR Kunz, G Yablonsky, A Fortunelli, ... Journal of the American Chemical Society 143 (29), 10998-11006, 2021 | 7 | 2021 |
| Integrated carbon capture and conversion: A review on C2+ product mechanisms and mechanism-guided strategies A Jana, SW Snyder, EJ Crumlin, J Qian Frontiers in Chemistry 11, 1135829, 2023 | 6 | 2023 |
| Real-Space Pseudopotential Method for the Calculation of 1s Core-Level Binding Energies Q Xu, D Prendergast, J Qian Journal of Chemical Theory and Computation 18 (9), 5471-5478, 2022 | 3 | 2022 |
| Digital twin: a Theorist's playground for APXPS and surface science J Qian, E Crumlin APS March Meeting Abstracts 2021, P61. 004, 2021 | 3 | 2021 |
| Probing growth of metal–organic frameworks with X-ray scattering and vibrational spectroscopy W Lu, E Zhang, J Qian, C Weeraratna, MN Jackson, C Zhu, JR Long, ... Physical Chemistry Chemical Physics 24 (42), 26102-26110, 2022 | 2 | 2022 |
| Carbon Capture: Theoretical Guidelines for Activated Carbon-Based CO2 Adsorption Material Evaluation DM Glenna, A Jana, Q Xu, Y Wang, Y Meng, Y Yang, M Neupane, L Wang, ... The Journal of Physical Chemistry Letters 14 (47), 10693-10699, 2023 | 1 | 2023 |
William A Goddard IIIProfessor Chemistry, Materials Science, Applied PhysicsVerified email at caltech.edu
