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The Journal of Physical Chemistry. A
|
March 12, 2008
Heterolytic bond dissociation in water: why is it so easy for C4H9Cl but not for C3H9SiCl?
Peifeng Su, Lingchun Song, Wei Wu, et al.
Journal of the American Chemical Society
|
October 14, 2004
Valence bond calculations of hydrogen transfer reactions: a general predictive pattern derived from theory
Peifeng Su, Lingchun Song, Wei Wu, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 13, 2016
A theoretical study of weak interactions in phenylenediamine homodimer clusters
Chengqian Yuan, Haiming Wu, Meiye Jia, et al.
Molecules (Basel, Switzerland)
|
February 13, 2025
A Density Functional Valence Bond Study on the Excited States
Xun Wu, Peikun Zheng, Tingzhen Chen, et al.
Inorganic Chemistry
|
May 19, 2022
Metal-Ligand Bonds in Rare Earth Metal-Biphenyl Complexes
Dajiang Huang, Fuming Ying, Sifeng Chen, et al.
Journal of Chemical Theory and Computation
|
December 20, 2016
Hamiltonian Matrix Correction Based Density Functional Valence Bond Method
Chen Zhou, Yang Zhang, Xiping Gong, et al.
The Journal of Physical Chemistry. A
|
January 9, 2026
Bonding Nature of Diabatic Representation in Nonlinear Hydrogen Atom Transfer Reactions
Yang Zhang, Guoxia Gou, Jiao Li, et al.
The Journal of Chemical Physics
|
July 22, 2022
A general tight-binding based energy decomposition analysis scheme for intermolecular interactions in large molecules
Yuan Xu, Shu Zhang, Erik Lindahl, et al.
Frontiers in Chemistry
|
May 2, 2019
λ-Density Functional Valence Bond: A Valence Bond-Based Multiconfigurational Density Functional Theory With a Single Variable Hybrid Parameter
Fuming Ying, Chen Zhou, Peikun Zheng, et al.
Journal of Chemical Theory and Computation
|
May 28, 2026
Toward Robust Three-State Diabatization: A Systematic Benchmark of O(3) Transformation Parameterizations
Yang Zhang, Jiao Li, Guoxia Gou, et al.
Page
of 7
Search research articles
Search
Showing results (41-50 of 69) with videos related to
Sort By:
Page
of 7
The Journal of Physical Chemistry. A
|
March 12, 2008
Heterolytic bond dissociation in water: why is it so easy for C4H9Cl but not for C3H9SiCl?
Peifeng Su, Lingchun Song, Wei Wu, et al.
Journal of the American Chemical Society
|
October 14, 2004
Valence bond calculations of hydrogen transfer reactions: a general predictive pattern derived from theory
Peifeng Su, Lingchun Song, Wei Wu, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 13, 2016
A theoretical study of weak interactions in phenylenediamine homodimer clusters
Chengqian Yuan, Haiming Wu, Meiye Jia, et al.
Molecules (Basel, Switzerland)
|
February 13, 2025
A Density Functional Valence Bond Study on the Excited States
Xun Wu, Peikun Zheng, Tingzhen Chen, et al.
Inorganic Chemistry
|
May 19, 2022
Metal-Ligand Bonds in Rare Earth Metal-Biphenyl Complexes
Dajiang Huang, Fuming Ying, Sifeng Chen, et al.
Journal of Chemical Theory and Computation
|
December 20, 2016
Hamiltonian Matrix Correction Based Density Functional Valence Bond Method
Chen Zhou, Yang Zhang, Xiping Gong, et al.
The Journal of Physical Chemistry. A
|
January 9, 2026
Bonding Nature of Diabatic Representation in Nonlinear Hydrogen Atom Transfer Reactions
Yang Zhang, Guoxia Gou, Jiao Li, et al.
The Journal of Chemical Physics
|
July 22, 2022
A general tight-binding based energy decomposition analysis scheme for intermolecular interactions in large molecules
Yuan Xu, Shu Zhang, Erik Lindahl, et al.
Frontiers in Chemistry
|
May 2, 2019
λ-Density Functional Valence Bond: A Valence Bond-Based Multiconfigurational Density Functional Theory With a Single Variable Hybrid Parameter
Fuming Ying, Chen Zhou, Peikun Zheng, et al.
Journal of Chemical Theory and Computation
|
May 28, 2026
Toward Robust Three-State Diabatization: A Systematic Benchmark of O(3) Transformation Parameterizations
Yang Zhang, Jiao Li, Guoxia Gou, et al.
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of 7