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The Journal of Chemical Physics|May 3, 2015
A seven-degree-of-freedom, time-dependent quantum dynamics study on the energy efficiency in surmounting the central energy barrier of the OH + CH3 → O + CH4 reactionPengxiu Yan, Yuping Wang, Yida Li, et al.
Physical Chemistry Chemical Physics : PCCP|March 19, 2014
A multilayered-representation, quantum mechanical/molecular mechanics study of the CH(3)Cl + F(-) reaction in aqueous solution: the reaction mechanism, solvent effects and potential of mean forceJingxue Zhang, Yulong Xu, Jie Chen, et al.
The Journal of Physical Chemistry Letters|July 29, 2025
Ultralow-Barrier CO Oxidation on Bi2O2S-Supported Single-Atom Catalysts: Mechanistic Insights and Electronic DescriptorsXingchen Jin, Ruoqi Zhang, Delu Gao, et al.
The Journal of Physical Chemistry. B|March 9, 2018
Catalytic Effect of Aqueous Solution in Water-Assisted Proton-Transfer Mechanism of 8-Hydroxy Guanine RadicalPeng Liu, Chen Li, Shengyu Wang, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|March 11, 2020
Hybrid Solvation Model with First Solvation Shell for Calculation of Solvation Free EnergyXin Xin, Xiao Niu, Wanqi Liu, et al.
Scientific Reports|August 12, 2017
Multi-level Quantum Mechanics and Molecular Mechanics Study of Ring Opening Process of Guanine Damage by Hydroxyl Radical in Aqueous SolutionPeng Liu, Qiong Wang, Meixing Niu, et al.
International Journal of Molecular Sciences|June 2, 2021
Catalytic Descriptors to Investigate Catalytic Power in the Reaction of Haloalkane Dehalogenase Enzyme with 1,2-DichloroethaneXin Xin, Chen Li, Delu Gao, et al.
The Journal of Physical Chemistry. A|November 20, 2025
Mechanistic Insights and Solvent Effects for the Ambident SCN- + CH3Cl Reaction in Aqueous Solution: A Multilevel QM/MM StudyNan Wang, Yilin Cheng, Chen Li, et al.
Cureus|November 12, 2025
Management of Venous Thromboembolism (VTE) Complication Following Limb Replantation: A Report of Two Cases and Literature ReviewJingjing Wen, Zhegang Zhou, Johnson Boey, et al.
Small (Weinheim an Der Bergstrasse, Germany)|July 29, 2026
A Review of Multiscale Structural Design for Electromagnetic Functionality Based on Graphene-Based FibersXinru Li, Shun Yi, Haofei Ma, et al.
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