| Simulating electronic excitation and dynamics with real-time propagation approach to TDDFT within plane-wave pseudopotential formulation C Shepard, R Zhou, DC Yost, Y Yao, Y Kanai The Journal of Chemical Physics 155 (10), 2021 | 28 | 2021 |
| Dynamical transition orbitals: A particle–hole description in real-time TDDFT dynamics R Zhou, Y Kanai The Journal of Chemical Physics 154 (5), 2021 | 12 | 2021 |
| Complete OSV-MP2 analytical gradient theory for molecular structure and dynamics simulations R Zhou, Q Liang, J Yang Journal of Chemical Theory and Computation 16 (1), 196-210, 2019 | 12 | 2019 |
| First-principles demonstration of nonadiabatic thouless pumping of electrons in a molecular system R Zhou, DC Yost, Y Kanai The Journal of Physical Chemistry Letters 12 (19), 4496-4503, 2021 | 6 | 2021 |
| First-principles approach for coupled quantum dynamics of electrons and protons in heterogeneous systems J Xu, R Zhou, V Blum, TE Li, S Hammes-Schiffer, Y Kanai Physical Review Letters 131 (23), 238002, 2023 | 5 | 2023 |
| Molecular control of floquet topological phase in non-adiabatic Thouless pumping R Zhou, Y Kanai The Journal of Physical Chemistry Letters 14 (36), 8205-8212, 2023 | 4 | 2023 |
| Real-time time-dependent density functional theory for simulating nonequilibrium electron dynamics J Xu, TE Carney, R Zhou, C Shepard, Y Kanai Journal of the American Chemical Society 146 (8), 5011-5029, 2024 | 3 | 2024 |
| Nuclear–electronic orbital approach to quantization of protons in periodic electronic structure calculations J Xu, R Zhou, Z Tao, C Malbon, V Blum, S Hammes-Schiffer, Y Kanai The Journal of Chemical Physics 156 (22), 2022 | 3 | 2022 |
| Lagrangian Formulation of Nuclear-Electronic Orbital Ehrenfest Dynamics with Real-time TDDFT for Extended Periodic Systems J Xu, R Zhou, TE Li, S Hammes-Schiffer, Y Kanai arXiv preprint arXiv:2407.18842, 2024 | | 2024 |
| Efficient exact exchange using Wannier functions and other related developments in planewave-pseudopotential implementation of RT-TDDFT C Shepard, R Zhou, J Bost, TE Carney, Y Yao, Y Kanai The Journal of Chemical Physics 161 (2), 2024 | | 2024 |
| All-electron $ BSE@ GW $ method with Numeric Atom-Centered Orbitals for Extended Systems R Zhou, Y Yao, V Blum, X Ren, Y Kanai arXiv preprint arXiv:2406.11122, 2024 | | 2024 |
| Theory of moment propagation for quantum dynamics in single-particle description NJ Boyer, C Shepard, R Zhou, J Xu, Y Kanai The Journal of Chemical Physics 160 (6), 2024 | | 2024 |
| First-Principles Theoretical Study of Non-equilibrium Electron Dynamics and Electronic Excitation R Zhou The University of North Carolina at Chapel Hill, 2024 | | 2024 |
Christopher Corey ShepardPostdoc, The University of North Carolina at Chapel Hill在 live.unc.edu 的电子邮件经过验证
