Exact dynamics of dissipative electronic systems and quantum transport: Hierarchical equations of motion approach J Jin, X Zheng, YJ Yan The Journal of chemical physics 128 (23), 2008 | 443 | 2008 |
Scaled‐up synthesis of amorphous NiFeMo oxides and their rapid surface reconstruction for superior oxygen evolution catalysis Y Duan, ZY Yu, SJ Hu, XS Zheng, CT Zhang, HH Ding, BC Hu, QQ Fu, ... Angewandte Chemie International Edition 58 (44), 15772-15777, 2019 | 438 | 2019 |
Improving band gap prediction in density functional theory from molecules to solids X Zheng, AJ Cohen, P Mori-Sánchez, X Hu, W Yang Physical review letters 107 (2), 026403, 2011 | 226 | 2011 |
Quantum-mechanical investigation of field-emission mechanism of a micrometer-long single-walled carbon nanotube X Zheng, GH Chen, Z Li, S Deng, N Xu Physical Review Letters, 2004 | 221 | 2004 |
Time-dependent density-functional theory for open systems X Zheng, F Wang, CY Yam, Y Mo, GH Chen Physical Review B 75 (19), 195127, 2007 | 212 | 2007 |
Identification of Cu(100)/Cu(111) Interfaces as Superior Active Sites for CO Dimerization During CO2 Electroreduction ZZ Wu, XL Zhang, ZZ Niu, FY Gao, PP Yang, LP Chi, L Shi, WS Wei, R Liu, ... Journal of the American Chemical Society 144 (1), 259-269, 2021 | 196 | 2021 |
Hierarchical Liouville-space approach for accurate and universal characterization of quantum impurity systems ZH Li, NH Tong, X Zheng, D Hou, JH Wei, J Hu, YJ Yan arXiv preprint arXiv:1207.6359, 2012 | 170 | 2012 |
High‐Curvature Transition‐Metal Chalcogenide Nanostructures with a Pronounced Proximity Effect Enable Fast and Selective CO2 Electroreduction FY Gao, SJ Hu, XL Zhang, YR Zheng, HJ Wang, ZZ Niu, PP Yang, ... Angewandte Chemie 132 (22), 8784-8790, 2020 | 162 | 2020 |
Synthesis of Sub‐2 nm Iron‐Doped NiSe2 Nanowires and Their Surface‐Confined Oxidation for Oxygen Evolution Catalysis C Gu, S Hu, X Zheng, MR Gao, YR Zheng, L Shi, Q Gao, X Zheng, W Chu, ... Angewandte Chemie 130 (15), 4084-4088, 2018 | 156 | 2018 |
Localized orbital scaling correction for systematic elimination of delocalization error in density functional approximations C Li, X Zheng, NQ Su, W Yang National Science Review 5 (2), 203-215, 2018 | 151 | 2018 |
Numerical approach to time-dependent quantum transport and dynamical Kondo transition X Zheng, J Jin, S Welack, M Luo, YJ Yan The Journal of chemical physics 130 (16), 2009 | 129 | 2009 |
Time-dependent density functional theory for quantum transport X Zheng, GH Chen, Y Mo, SK Koo, H Tian, CY Yam, YJ Yan The Journal of chemical physics 133 (11), 2010 | 124 | 2010 |
Single-molecule conductance of pyridine-terminated dithienylethene switch molecules ES Tam, JJ Parks, WW Shum, YW Zhong, MEB Santiago-Berríos, X Zheng, ... Acs Nano 5 (6), 5115-5123, 2011 | 110 | 2011 |
HEOM‐QUICK: a program for accurate, efficient, and universal characterization of strongly correlated quantum impurity systems LZ Ye, X Wang, D Hou, RX Xu, X Zheng, YJ Yan Wiley Interdisciplinary Reviews: Computational Molecular Science 6 (6), 608-638, 2016 | 108 | 2016 |
Local scaling correction for reducing delocalization error in density functional approximations C Li, X Zheng, AJ Cohen, P Mori-Sánchez, W Yang Physical review letters 114 (5), 053001, 2015 | 93 | 2015 |
A general strategy to immobilize single‐atom catalysts in metal–organic frameworks for enhanced photocatalysis J Sui, H Liu, S Hu, K Sun, G Wan, H Zhou, X Zheng, HL Jiang Advanced Materials 34 (6), 2109203, 2022 | 92 | 2022 |
Polymorphic cobalt diselenide as extremely stable electrocatalyst in acidic media via a phase-mixing strategy XL Zhang, SJ Hu, YR Zheng, R Wu, FY Gao, PP Yang, ZZ Niu, C Gu, X Yu, ... Nature Communications 10 (1), 5338, 2019 | 80 | 2019 |
Kondo memory in driven strongly correlated quantum dots X Zheng, YJ Yan, M Di Ventra Physical Review Letters 111 (8), 086601, 2013 | 80 | 2013 |
Dissipation equation of motion approach to open quantum systems YJ Yan, J Jin, RX Xu, X Zheng Frontiers of Physics 11, 1-27, 2016 | 78 | 2016 |
Delocalization error of density-functional approximations: A distinct manifestation in hydrogen molecular chains X Zheng, M Liu, ER Johnson, J Contreras-García, W Yang The Journal of chemical physics 137 (21), 2012 | 76 | 2012 |