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Physical Chemistry Chemical Physics : PCCP
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July 19, 2018
Probing the π → π* photoisomerization mechanism of trans-azobenzene by multi-state ab initio on-the-fly trajectory dynamics simulations
Chao Xu, Le Yu, Feng Long Gu, et al.
RSC Advances
|
May 6, 2022
A nonlinear optical switch induced by an external electric field: inorganic alkaline-earth alkalide
Bo Li, Daoling Peng, Feng Long Gu, et al.
Journal of Chemical Theory and Computation
|
November 20, 2025
Electronic Excitation Energy Calculations with Configuration Interaction Based on Nonorthogonal Localized Molecular Orbitals
Feng Long Gu, Daoling Peng, Liang Peng, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 15, 2015
Theoretical study on catalyzed selective photoreduction mechanism for 4-bromobenzaldehyde in two different solvents
Xiao Huang, Liang Peng, Feng Long Gu, et al.
Physical Chemistry Chemical Physics : PCCP
|
February 15, 2021
Photoisomerization-mechanism-associated excited-state hydrogen transfer in 2'-hydroxychalcone revealed by on-the-fly trajectory surface-hopping molecular dynamics simulation
Ying Hu, Ling Yue, Feng Long Gu, et al.
Journal of Chemical Theory and Computation
|
January 21, 2026
Correction to "Electronic Excitation Energy Calculations with Configuration Interaction Based on Nonorthogonal Localized Molecular Orbitals"
Feng Long Gu, Daoling Peng, Liang Peng, et al.
Journal of Computational Chemistry
|
December 19, 2009
Describing electron correlation effects in the framework of the elongation method--elongation-MP2: formalism, implementation and efficiency
Marcin Makowski, Jacek Korchowiec, Feng Long Gu, et al.
The Journal of Chemical Physics
|
September 4, 2007
Nonlinear optical properties of polydiacetylene with donor-acceptor substitution block
Shin-Ichi Ohnishi, Yuuichi Orimoto, Feng Long Gu, et al.
Journal of Computational Chemistry
|
July 16, 2009
Theoretical study on nonlinear optical properties of the Li(+)[calix[4]pyrrole]Li(-)dimer, trimer and its polymer with diffuse excess electrons
Guang Tao Yu, Wei Chen, Feng Long Gu, et al.
The Journal of Chemical Physics
|
November 20, 2004
A new localization scheme for the elongation method
Feng Long Gu, Yuriko Aoki, Jacek Korchowiec, et al.
Page
of 9
Search research articles
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Showing results (21-30 of 85) with videos related to
Sort By:
Page
of 9
Physical Chemistry Chemical Physics : PCCP
|
July 19, 2018
Probing the π → π* photoisomerization mechanism of trans-azobenzene by multi-state ab initio on-the-fly trajectory dynamics simulations
Chao Xu, Le Yu, Feng Long Gu, et al.
RSC Advances
|
May 6, 2022
A nonlinear optical switch induced by an external electric field: inorganic alkaline-earth alkalide
Bo Li, Daoling Peng, Feng Long Gu, et al.
Journal of Chemical Theory and Computation
|
November 20, 2025
Electronic Excitation Energy Calculations with Configuration Interaction Based on Nonorthogonal Localized Molecular Orbitals
Feng Long Gu, Daoling Peng, Liang Peng, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 15, 2015
Theoretical study on catalyzed selective photoreduction mechanism for 4-bromobenzaldehyde in two different solvents
Xiao Huang, Liang Peng, Feng Long Gu, et al.
Physical Chemistry Chemical Physics : PCCP
|
February 15, 2021
Photoisomerization-mechanism-associated excited-state hydrogen transfer in 2'-hydroxychalcone revealed by on-the-fly trajectory surface-hopping molecular dynamics simulation
Ying Hu, Ling Yue, Feng Long Gu, et al.
Journal of Chemical Theory and Computation
|
January 21, 2026
Correction to "Electronic Excitation Energy Calculations with Configuration Interaction Based on Nonorthogonal Localized Molecular Orbitals"
Feng Long Gu, Daoling Peng, Liang Peng, et al.
Journal of Computational Chemistry
|
December 19, 2009
Describing electron correlation effects in the framework of the elongation method--elongation-MP2: formalism, implementation and efficiency
Marcin Makowski, Jacek Korchowiec, Feng Long Gu, et al.
The Journal of Chemical Physics
|
September 4, 2007
Nonlinear optical properties of polydiacetylene with donor-acceptor substitution block
Shin-Ichi Ohnishi, Yuuichi Orimoto, Feng Long Gu, et al.
Journal of Computational Chemistry
|
July 16, 2009
Theoretical study on nonlinear optical properties of the Li(+)[calix[4]pyrrole]Li(-)dimer, trimer and its polymer with diffuse excess electrons
Guang Tao Yu, Wei Chen, Feng Long Gu, et al.
The Journal of Chemical Physics
|
November 20, 2004
A new localization scheme for the elongation method
Feng Long Gu, Yuriko Aoki, Jacek Korchowiec, et al.
Page
of 9