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Journal of Chemical Theory and Computation|March 16, 2024
Consistent Construction of the Density Matrix from Surface Hopping TrajectoriesJiabo Xu, Zhecun Shi, Linjun Wang
Journal of Physics. Condensed Matter : an Institute of Physics Journal|May 16, 2023
Large-scale surface hopping simulation of charge transport in hexagonal molecular crystals: role of electronic coupling signsZirui Wang, Jiawei Dong, Linjun Wang
Advanced Materials (Deerfield Beach, Fla.)|December 25, 2010
Evaluation of charge mobility in organic materials: from localized to delocalized descriptions at a first-principles levelZhigang Shuai, Linjun Wang, Qikai Li
The Journal of Physical Chemistry Letters|July 17, 2018
Crossing Classified and Corrected Fewest Switches Surface HoppingJing Qiu, Xin Bai, Linjun Wang
Zhonghua Wei Chang Wai Ke Za Zhi = Chinese Journal of Gastrointestinal Surgery|November 14, 2017
[Selection and appraisal of digestive tract reconstruction after totally laparoscopic gastrectomy for gastric cancer]Linjun Wang, Hao Xu, Zekuan Xu
The Journal of Physical Chemistry Letters|June 20, 2023
Structural Evolution of Cadmium Selenide Clusters: An Unbiased Global Optimization Study of (CdSe) for 5 ≤ N ≤ 80Haiwei Lei, Liping Chen, Linjun Wang
The Journal of Chemical Physics|July 9, 2021
Branching and phase corrected surface hopping: A benchmark of nonadiabatic dynamics in multilevel systemsCancan Shao, Jiabo Xu, Linjun Wang
The Journal of Chemical Physics|April 22, 2025
Coupled-trajectory surface hopping with sign consistencyRixin Xie, Zhecun Shi, Linjun Wang
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