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Journal of Chemical Theory and Computation
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April 25, 2017
Multiple-State Nonadiabatic Dynamics Simulation of Photoisomerization of Acetylacetone with the Direct ab Initio QTMF Approach
Binbin Xie, Ganglong Cui, Wei-Hai Fang
Advances in Protein Chemistry and Structural Biology
|
September 30, 2015
Excited States and Photochemistry of Chromophores in the Photoactive Proteins Explored by the Combined Quantum Mechanical and Molecular Mechanical Calculations
Lihong Liu, Ganglong Cui, Wei-Hai Fang
The Journal of Chemical Physics
|
October 24, 2014
Mechanistic photodecarboxylation of pyruvic acid: excited-state proton transfer and three-state intersection
Xue-Ping Chang, Qiu Fang, Ganglong Cui
The Journal of Physical Chemistry. A
|
March 29, 2007
S1 and S2 excited states of gas-phase Schiff-base retinal chromophores: a time-dependent density functional theoretical investigation
Mengtao Sun, Yong Ding, Ganglong Cui, et al.
The Journal of Physical Chemistry Letters
|
December 3, 2019
Integrating Machine Learning with the Multilayer Energy-Based Fragment Method for Excited States of Large Systems
Wen-Kai Chen, Wei-Hai Fang, Ganglong Cui
The Journal of Chemical Physics
|
February 1, 2023
Extending multi-layer energy-based fragment method for excited-state calculations of large covalently bonded fragment systems
Wen-Kai Chen, Wei-Hai Fang, Ganglong Cui
The Journal of Physical Chemistry. A
|
September 25, 2019
QM/MM Studies on the Photophysical Mechanism of a Truncated Octocrylene Model
Xue-Ping Chang, Ye-Guang Fang, Ganglong Cui
The Journal of Physical Chemistry. A
|
June 19, 2014
Photoinduced proton transfer and isomerization in a hydrogen-bonded aromatic azo compound: a CASPT2//CASSCF study
Ganglong Cui, Pei-Jie Guan, Wei-Hai Fang
The Journal of Physical Chemistry. A
|
December 17, 2013
Nonequilibrium H/D isotope effects from trajectory-based nonadiabatic dynamics
Lasse Spörkel, Ganglong Cui, Axel Koslowski, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 10, 2019
A multi-layer energy-based fragment method for excited states and nonadiabatic dynamics
Wen-Kai Chen, Wei-Hai Fang, Ganglong Cui
Page
of 20
Search research articles
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Showing results (21-30 of 192) with videos related to
Sort By:
Page
of 20
Journal of Chemical Theory and Computation
|
April 25, 2017
Multiple-State Nonadiabatic Dynamics Simulation of Photoisomerization of Acetylacetone with the Direct ab Initio QTMF Approach
Binbin Xie, Ganglong Cui, Wei-Hai Fang
Advances in Protein Chemistry and Structural Biology
|
September 30, 2015
Excited States and Photochemistry of Chromophores in the Photoactive Proteins Explored by the Combined Quantum Mechanical and Molecular Mechanical Calculations
Lihong Liu, Ganglong Cui, Wei-Hai Fang
The Journal of Chemical Physics
|
October 24, 2014
Mechanistic photodecarboxylation of pyruvic acid: excited-state proton transfer and three-state intersection
Xue-Ping Chang, Qiu Fang, Ganglong Cui
The Journal of Physical Chemistry. A
|
March 29, 2007
S1 and S2 excited states of gas-phase Schiff-base retinal chromophores: a time-dependent density functional theoretical investigation
Mengtao Sun, Yong Ding, Ganglong Cui, et al.
The Journal of Physical Chemistry Letters
|
December 3, 2019
Integrating Machine Learning with the Multilayer Energy-Based Fragment Method for Excited States of Large Systems
Wen-Kai Chen, Wei-Hai Fang, Ganglong Cui
The Journal of Chemical Physics
|
February 1, 2023
Extending multi-layer energy-based fragment method for excited-state calculations of large covalently bonded fragment systems
Wen-Kai Chen, Wei-Hai Fang, Ganglong Cui
The Journal of Physical Chemistry. A
|
September 25, 2019
QM/MM Studies on the Photophysical Mechanism of a Truncated Octocrylene Model
Xue-Ping Chang, Ye-Guang Fang, Ganglong Cui
The Journal of Physical Chemistry. A
|
June 19, 2014
Photoinduced proton transfer and isomerization in a hydrogen-bonded aromatic azo compound: a CASPT2//CASSCF study
Ganglong Cui, Pei-Jie Guan, Wei-Hai Fang
The Journal of Physical Chemistry. A
|
December 17, 2013
Nonequilibrium H/D isotope effects from trajectory-based nonadiabatic dynamics
Lasse Spörkel, Ganglong Cui, Axel Koslowski, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 10, 2019
A multi-layer energy-based fragment method for excited states and nonadiabatic dynamics
Wen-Kai Chen, Wei-Hai Fang, Ganglong Cui
Page
of 20