Zhenggang Lan

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 23

Top Topics

Lipopolysaccharide Induced

Energy Transfer

Transition Metal

Top Venues

Physical chemistry chemical physics : PCCP

The journal of physical chemistry letters

Journal of chemical theory and computation

The Journal of chemical physics

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

Publications

Yifei Zhu, Jiawei Peng, Chao Xu, Zhenggang Lan
Unsupervised Machine Learning in the Analysis of Nonadiabatic Molecular Dynamics Simulation. The journal of physical chemistry letters (2024)
Sisi Liu, Jiawei Peng, Peng Bao, Qiang Shi, Zhenggang Lan
Ultrafast Excited-State Energy Transfer in Phenylene Ethynylene Dendrimer: Quantum Dynamics with the Tensor Network Method. The journal of physical chemistry. A 128 (31) (2024)
Sisi Liu, Jiawei Peng, Peng Bao, Qiang Shi, Zhenggang Lan
Ultrafast Excited-State Energy Transfer in Phenylene Ethynylene Dendrimer: Quantum Dynamics with the Tensor Network Method. The journal of physical chemistry. A (2024)
Jianzheng Ma, Di Zhao, Le Yu, Chenwei Jiang, Zhenggang Lan, Fuli Li
Simultaneously improving the efficiencies of photo- and thermal isomerization of an oxindole-based light-driven molecular rotary motor by a structural redesign. Physical chemistry chemical physics : PCCP 25 (18) (2023)
Jianzheng Ma, Di Zhao, Le Yu, Chenwei Jiang, Zhenggang Lan, Fuli Li
Simultaneously improving the efficiencies of photo- and thermal isomerization of an oxindole-based light-driven molecular rotary motor by a structural redesign. Physical chemistry chemical physics : PCCP 25 (18) (2023)
Yutai Zhang, Chao Xu, Zhenggang Lan
Automated Exploration of Reaction Networks and Mechanisms Based on Metadynamics Nanoreactor Simulations. Journal of chemical theory and computation (2023)
Juanjuan Zhang, Jiawei Peng, Yifei Zhu, Deping Hu, Zhenggang Lan
Influence of Mode-Specific Excitation on the Nonadiabatic Dynamics of Methyl Nitrate (CH 3 ONO 2 ). The journal of physical chemistry letters (2023)
Jianzheng Ma, Di Zhao, Le Yu, Chenwei Jiang, Zhenggang Lan, Fuli Li
Simultaneously improving the efficiencies of photo- and thermal isomerization of an oxindole-based light-driven molecular rotary motor by a structural redesign. Physical chemistry chemical physics : PCCP (2023)
Chao Xu, Kunni Lin, Deping Hu, Feng Long Gu, Maxim F Gelin, Zhenggang Lan
Ultrafast Internal Conversion Dynamics through the on-the-Fly Simulation of Transient Absorption Pump-Probe Spectra with Different Electronic Structure Methods. The journal of physical chemistry letters 13 (2) (2022)
Jianzheng Ma, Di Zhao, Chenwei Jiang, Zhenggang Lan, Fuli Li
Effect of Temperature on Photoisomerization Dynamics of a Newly Designed Two-Stroke Light-Driven Molecular Rotary Motor. International journal of molecular sciences 23 (17) (2022)
Kunni Lin, Jiawei Peng, Chao Xu, Feng Long Gu, Zhenggang Lan
Automatic Evolution of Machine-Learning-Based Quantum Dynamics with Uncertainty Analysis. Journal of chemical theory and computation 18 (10) (2022)
Yuan Fang, Haiyi Huang, Kunni Lin, Chao Xu, Feng Long Gu, Zhenggang Lan
The impact of different geometrical restrictions on the nonadiabatic photoisomerization of biliverdin chromophores. Physical chemistry chemical physics : PCCP 24 (42) (2022)
Qinghai Cui, Jiawei Peng, Chao Xu, Zhenggang Lan
Automatic Approach to Explore the Multireaction Mechanism for Medium-Sized Bimolecular Reactions via Collision Dynamics Simulations and Transition State Searches. Journal of chemical theory and computation 18 (2) (2022)
Kunni Lin, Jiawei Peng, Chao Xu, Feng Long Gu, Zhenggang Lan
Trajectory Propagation of Symmetrical Quasi-classical Dynamics with Meyer-Miller Mapping Hamiltonian Using Machine Learning. The journal of physical chemistry letters (2022)
Jianzheng Ma, Sujie Yang, Di Zhao, Chenwei Jiang, Zhenggang Lan, Fuli Li
Design and Nonadiabatic Photoisomerization Dynamics Study of a Three-Stroke Light-Driven Molecular Rotary Motor. International journal of molecular sciences 23 (7) (2022)
Kunni Lin, Jiawei Peng, Chao Xu, Feng Long Gu, Zhenggang Lan
Trajectory Propagation of Symmetrical Quasi-classical Dynamics with Meyer-Miller Mapping Hamiltonian Using Machine Learning. The journal of physical chemistry letters 13 (50) (2022)
Yifei Zhu, Jiawei Peng, Xu Kang, Chao Xu, Zhenggang Lan
The principal component analysis of the ring deformation in the nonadiabatic surface hopping dynamics. Physical chemistry chemical physics : PCCP 24 (39) (2022)
Juanjuan Zhang, Jiawei Peng, Deping Hu, Zhenggang Lan
Investigation of nonadiabatic dynamics in the photolysis of methyl nitrate (CH3ONO2) by on-the-fly surface hopping simulation. Physical chemistry chemical physics : PCCP 23 (45) (2021)
Jie Liu, Zhenggang Lan, Jinglong Yang
An efficient implementation of spin-orbit coupling within the framework of semiempirical orthogonalization-corrected methods for ultrafast intersystem crossing dynamics. Physical chemistry chemical physics : PCCP 23 (39) (2021)
Kunni Lin, Jiawei Peng, Feng Long Gu, Zhenggang Lan
Simulation of Open Quantum Dynamics with Bootstrap-Based Long Short-Term Memory Recurrent Neural Network. The journal of physical chemistry letters 12 (41) (2021)
Xiang Jiang, Qijing Zheng, Zhenggang Lan, Wissam A Saidi, Xinguo Ren, Jin Zhao
Real-time GW-BSE investigations on spin-valley exciton dynamics in monolayer transition metal dichalcogenide. Science advances 7 (10) (2021)
Xusong Li, Deping Hu, Yu Xie, Zhenggang Lan
Analysis of trajectory similarity and configuration similarity in on-the-fly surface-hopping simulation on multi-channel nonadiabatic photoisomerization dynamics. The Journal of chemical physics 149 (24) (2019)
Yu Xie, Jie Zheng, Zhenggang Lan
Performance evaluation of the symmetrical quasi-classical dynamics method based on Meyer-Miller mapping Hamiltonian in the treatment of site-exciton models. The Journal of chemical physics 149 (17) (2018)