| Organic-to-inorganic structural chirality transfer in a 2D hybrid perovskite and impact on Rashba-Dresselhaus spin-orbit coupling MK Jana, R Song, H Liu, DR Khanal, SM Janke, R Zhao, C Liu, ... Nature communications 11 (1), 4699, 2020 | 304 | 2020 |
| Structural descriptor for enhanced spin-splitting in 2D hybrid perovskites MK Jana, R Song, Y Xie, R Zhao, PC Sercel, V Blum, DB Mitzi Nature communications 12 (1), 4982, 2021 | 126 | 2021 |
| A new insight into π–π stacking involving remarkable orbital interactions R Zhao, RQ Zhang Physical Chemistry Chemical Physics 18 (36), 25452-25457, 2016 | 66 | 2016 |
| Higher-generation type III-B rotaxane dendrimers with controlling particle size in three-dimensional molecular switching CS Kwan, R Zhao, MA Van Hove, Z Cai, KCF Leung Nature communications 9 (1), 497, 2018 | 41 | 2018 |
| Multi-functional switch effect in interlocking molecular rotators-on-graphene systems using electric fields X Li, F Qi, R Zhao, Z Qiu, Y Li, M Long, G Zhou Journal of Materials Chemistry C 10 (13), 5292-5302, 2022 | 24 | 2022 |
| Interlocking molecular gear chains built on surfaces R Zhao, F Qi, YL Zhao, KE Hermann, RQ Zhang, MA Van Hove The Journal of Physical Chemistry Letters 9 (10), 2611-2619, 2018 | 24 | 2018 |
| Exact two-component relativistic energy band theory and application R Zhao, Y Zhang, Y Xiao, W Liu The Journal of Chemical Physics 144 (4), 2016 | 23 | 2016 |
| Interlocking mechanism between molecular gears attached to surfaces R Zhao, YL Zhao, F Qi, KE Hermann, RQ Zhang, MA Van Hove ACS nano 12 (3), 3020-3029, 2018 | 22 | 2018 |
| How does the flexibility of molecules affect the performance of molecular rotors? R Zhao, F Qi, RQ Zhang, MA Van Hove The Journal of Physical Chemistry C 122 (43), 25067-25074, 2018 | 18 | 2018 |
| A scheme of numerical solution for three‐dimensional isoelectronic series of hydrogen atom using one‐dimensional basis functions FU Rahman, R Zhao, YP Sarwono, RQ Zhang International Journal of Quantum Chemistry 118 (19), e25694, 2018 | 16 | 2018 |
| Quasi-four-component method with numeric atom-centered orbitals for relativistic density functional simulations of molecules and solids R Zhao, VW Yu, K Zhang, Y Xiao, Y Zhang, V Blum Physical Review B 103 (24), 245144, 2021 | 14 | 2021 |
| Beyond the electrostatic model: the significant roles of orbital interaction and the dispersion effect in aqueous–π systems R Zhao, RQ Zhang Physical Chemistry Chemical Physics 19 (2), 1298-1302, 2017 | 9 | 2017 |
| Fragment motion in motor molecules: basic concepts and application to intra-molecular rotations KE Hermann, F Qi, R Zhao, RQ Zhang, MA Van Hove Physical Chemistry Chemical Physics 20 (33), 21487-21497, 2018 | 6 | 2018 |
| Surface-mounted dipolar molecular rotors driven by external electric field, as revealed by torque analyses YL Zhao, W Lin, K Jitapunkul, R Zhao, RQ Zhang, MA Van Hove ACS omega 7 (39), 35159-35169, 2022 | 3 | 2022 |
| Intermolecular orbital interaction in π systems R Zhao, RQ Zhang Molecular Physics 116 (7-8), 978-986, 2018 | 3 | 2018 |
| Tunneling lifetimes of electrons escaping from atoms under a static electric field R Zhao, YP Sarwono, RQ Zhang The Journal of Chemical Physics 147 (6), 2017 | 3 | 2017 |
| Substrate-mediated and temperature-modulated long-range interactions between bromine adatom stripes on Cu (1 1 1) YL Zhao, R Zhao, F Qi, RQ Zhang, MA Van Hove Applied Surface Science 463, 253-260, 2019 | 2 | 2019 |
| Improved projected Green's function approach to electron tunneling lifetime calculations in quantum wells HS Tao, R Zhao, YP Sarwono, RQ Zhang Physical Review B 96 (23), 235428, 2017 | 2 | 2017 |
| Density functional theory study of two-dimensional hybrid organic-inorganic perovskites: frontier level alignment and chirality-induced spin splitting R Song, R Zhao AAPPS Bulletin 34 (1), 20, 2024 | 1 | 2024 |
| Efficient and accurate fully relativistic density functional treatment for molecules and periodic solids R Zhao, V Yu, K Zhang, Y Xiao, Y Zhang, W Liu, V Blum Bulletin of the American Physical Society 65, 2020 | 1 | 2020 |
