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The Journal of Chemical Physics
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August 22, 2024
Real-space energy decomposition analysis method for qualitative and quantitative interpretations
Yueyang Zhang, Xuewei Xiong, Wei Wu, et al.
The Journal of Physical Chemistry. A
|
November 26, 2024
Energy Decomposition Analysis Method Based on the Constrained Active Space Unrestricted Mean-Field Method
Shixuan Chen, Fuming Ying, Wei Wu, et al.
Chemical Reviews
|
August 19, 2011
Classical valence bond approach by modern methods
Wei Wu, Peifeng Su, Sason Shaik, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
May 30, 2008
A valence bond study of the low-lying states of the NF molecule
Peifeng Su, Wei Wu, Sason Shaik, et al.
The Journal of Physical Chemistry Letters
|
March 17, 2021
Correction to "Diabatization around Conical Intersections with a New Phase-Corrected Valence-Bond-Based Compression Approach"
Yang Zhang, Wei Wang, Benjamin Lasorne, et al.
The Journal of Physical Chemistry Letters
|
June 11, 2020
A Novel Valence-Bond-Based Automatic Diabatization Method by Compression
Yang Zhang, Peifeng Su, Benjamin Lasorne, et al.
The Journal of Physical Chemistry Letters
|
February 15, 2021
Diabatization around Conical Intersections with a New Phase-Corrected Valence-Bond-Based Compression Approach
Yang Zhang, Wei Wang, Benjamin Lasorne, et al.
The Journal of Chemical Physics
|
January 3, 2020
Energy decomposition analysis based on broken symmetry unrestricted density functional theory
Zhen Tang, Zhen Jiang, Hongjiang Chen, et al.
Molecules (Basel, Switzerland)
|
January 27, 2021
A Valence-Bond-Based Multiconfigurational Density Functional Theory: The λ-DFVB Method Revisited
Peikun Zheng, Chenru Ji, Fuming Ying, et al.
Nature Communications
|
October 11, 2024
Author Correction: Molecular-strain induced phosphinidene reactivity of a phosphanorcaradiene
Yizhen Chen, Peifeng Su, Dongmin Wang, et al.
Page
of 7
Search research articles
Search
Showing results (21-30 of 69) with videos related to
Sort By:
Page
of 7
The Journal of Chemical Physics
|
August 22, 2024
Real-space energy decomposition analysis method for qualitative and quantitative interpretations
Yueyang Zhang, Xuewei Xiong, Wei Wu, et al.
The Journal of Physical Chemistry. A
|
November 26, 2024
Energy Decomposition Analysis Method Based on the Constrained Active Space Unrestricted Mean-Field Method
Shixuan Chen, Fuming Ying, Wei Wu, et al.
Chemical Reviews
|
August 19, 2011
Classical valence bond approach by modern methods
Wei Wu, Peifeng Su, Sason Shaik, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
May 30, 2008
A valence bond study of the low-lying states of the NF molecule
Peifeng Su, Wei Wu, Sason Shaik, et al.
The Journal of Physical Chemistry Letters
|
March 17, 2021
Correction to "Diabatization around Conical Intersections with a New Phase-Corrected Valence-Bond-Based Compression Approach"
Yang Zhang, Wei Wang, Benjamin Lasorne, et al.
The Journal of Physical Chemistry Letters
|
June 11, 2020
A Novel Valence-Bond-Based Automatic Diabatization Method by Compression
Yang Zhang, Peifeng Su, Benjamin Lasorne, et al.
The Journal of Physical Chemistry Letters
|
February 15, 2021
Diabatization around Conical Intersections with a New Phase-Corrected Valence-Bond-Based Compression Approach
Yang Zhang, Wei Wang, Benjamin Lasorne, et al.
The Journal of Chemical Physics
|
January 3, 2020
Energy decomposition analysis based on broken symmetry unrestricted density functional theory
Zhen Tang, Zhen Jiang, Hongjiang Chen, et al.
Molecules (Basel, Switzerland)
|
January 27, 2021
A Valence-Bond-Based Multiconfigurational Density Functional Theory: The λ-DFVB Method Revisited
Peikun Zheng, Chenru Ji, Fuming Ying, et al.
Nature Communications
|
October 11, 2024
Author Correction: Molecular-strain induced phosphinidene reactivity of a phosphanorcaradiene
Yizhen Chen, Peifeng Su, Dongmin Wang, et al.
Page
of 7