Xu Han

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 7

Top Topics

Liquid Chromatography

Electron Transfer

Top Venues

Journal of chemical theory and computation

The journal of physical chemistry. A

The journal of physical chemistry letters

The Journal of chemical physics

This page only lists publications with an associated author ORCID identifier.

Publications

Sihao Yuan, Xu Han, Jun Zhang, Zhaoxin Xie, Cheng Fan, Yunlong Xiao, Yi Qin Gao, Yi Isaac Yang
Generating High-Precision Force Fields for Molecular Dynamics Simulations to Study Chemical Reaction Mechanisms Using Molecular Configuration Transformer. The journal of physical chemistry. A (2024)
Sihao Yuan, Xu Han, Jun Zhang, Zhaoxin Xie, Cheng Fan, Yunlong Xiao, Yi Qin Gao, Yi Isaac Yang
Generating High-Precision Force Fields for Molecular Dynamics Simulations to Study Chemical Reaction Mechanisms Using Molecular Configuration Transformer. The journal of physical chemistry. A 128 (21) (2024)
Jun Zhang, Dechin Chen, Yijie Xia, Yu-Peng Huang, Xiaohan Lin, Xu Han, Ningxi Ni, Zidong Wang, Fan Yu, Lijiang Yang, Yi Isaac Yang, Yi Qin Gao
Artificial Intelligence Enhanced Molecular Simulations. Journal of chemical theory and computation (2023)
Maodong Li, Jun Zhang, Haiyang Niu, Yao-Kun Lei, Xu Han, Lijiang Yang, Zhi-Qiang Ye, Yi Isaac Yang, Yi Qin Gao
Phase Transition between Crystalline Variants of Ordinary Ice. The journal of physical chemistry letters 13 (36) (2022)
Xu Han, Jun Zhang, Yi Isaac Yang, Zhen Zhang, Lijiang Yang, Yi Qin Gao
Enhanced Sampling Simulation Reveals How Solvent Influences Chirogenesis of the Intra-Molecular Diels-Alder Reaction. Journal of chemical theory and computation 18 (7) (2022)
Yao-Kun Lei, Zhen Zhang, Xu Han, Yi Isaac Yang, Jun Zhang, Yi Qin Gao
Locating Transition Zone in Phase Space. Journal of chemical theory and computation 18 (10) (2022)
Dezhang Li, Xu Han, Yichen Chai, Cong Wang, Zhijun Zhang, Zifei Chen, Jian Liu, Jiushu Shao
Stationary state distribution and efficiency analysis of the Langevin equation via real or virtual dynamics. The Journal of chemical physics 147 (18) (2018)