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The Journal of Physical Chemistry Letters
|
November 1, 2019
Quasi-Diabatic Scheme for Nonadiabatic On-the-Fly Simulations
Wanghuai Zhou, Arkajit Mandal, Pengfei Huo
The Journal of Chemical Physics
|
September 15, 2022
Nuclear gradient expressions for molecular cavity quantum electrodynamics simulations using mixed quantum-classical methods
Wanghuai Zhou, Deping Hu, Arkajit Mandal, et al.
Physical Review Letters
|
October 5, 2020
Resolution of Gauge Ambiguities in Molecular Cavity Quantum Electrodynamics
Michael A D Taylor, Arkajit Mandal, Wanghuai Zhou, et al.
Journal of Chemical Theory and Computation
|
December 22, 2025
Modeling Nonadiabatic Dynamics with Dissipation: Application to Cavity Polaritons
Wanghuai Zhou, Bernard Okine, Dingyi Shen, et al.
The Journal of Chemical Physics
|
January 9, 2025
Photon-mediated energy transfer between molecules and atoms in a cavity: A numerical study
Jun Zhang, Shaohong Wang, Mengdi Guo, et al.
The Journal of Chemical Physics
|
September 17, 2025
Gate-controlled two-stage Kondo effect in a metal-free polycyclic aromatic hydrocarbon diradical molecular switch: A DFT+NRG insight
Zhi-Hong Yuan, Guanfei Gong, Tao Jing, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 6) with videos related to
Sort By:
Page
of 1
The Journal of Physical Chemistry Letters
|
November 1, 2019
Quasi-Diabatic Scheme for Nonadiabatic On-the-Fly Simulations
Wanghuai Zhou, Arkajit Mandal, Pengfei Huo
The Journal of Chemical Physics
|
September 15, 2022
Nuclear gradient expressions for molecular cavity quantum electrodynamics simulations using mixed quantum-classical methods
Wanghuai Zhou, Deping Hu, Arkajit Mandal, et al.
Physical Review Letters
|
October 5, 2020
Resolution of Gauge Ambiguities in Molecular Cavity Quantum Electrodynamics
Michael A D Taylor, Arkajit Mandal, Wanghuai Zhou, et al.
Journal of Chemical Theory and Computation
|
December 22, 2025
Modeling Nonadiabatic Dynamics with Dissipation: Application to Cavity Polaritons
Wanghuai Zhou, Bernard Okine, Dingyi Shen, et al.
The Journal of Chemical Physics
|
January 9, 2025
Photon-mediated energy transfer between molecules and atoms in a cavity: A numerical study
Jun Zhang, Shaohong Wang, Mengdi Guo, et al.
The Journal of Chemical Physics
|
September 17, 2025
Gate-controlled two-stage Kondo effect in a metal-free polycyclic aromatic hydrocarbon diradical molecular switch: A DFT+NRG insight
Zhi-Hong Yuan, Guanfei Gong, Tao Jing, et al.
Page
of 1