Chaoyuan Zhu

Publication Activity (10 Years)

Years Active: 2019-2020
Publications (10 Years): 2

Top Topics

Molecular Dynamics

Biologically Inspired

Stereo Matching

Top Venues

J. Comput. Chem.

Publications

Linfeng Ye, Chao Xu, Feng Long Gu, Chaoyuan Zhu
Functional and Basis Set Dependence for Time-Dependent Density Functional Theory Trajectory Surface Hopping Molecular Dynamics: Cis-Azobenzene Photoisomerization. J. Comput. Chem. 41 (7) (2020)
Yan Ying Liang, Bo Li, Xuan Xu, Feng Long Gu, Chaoyuan Zhu
A Density Functional Theory Study on Nonlinear Optical Properties of Double Cage Excess Electron Compounds: Theoretically Design M[Cu(Ag)@(NH3)n](M = Be, Mg and Ca; n = 1-3). J. Comput. Chem. 40 (9) (2019)