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Journal of Computational Chemistry
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March 12, 2014
Investigation of the distinction between van der Waals interaction and chemical bonding based on the PAEM-MO diagram
Dong-Xia Zhao, Zhong-Zhi Yang
The Journal of Physical Chemistry. A
|
August 12, 2014
Theoretical exploration of the potential and force acting on one electron within a molecule
Dong-Xia Zhao, Zhong-Zhi Yang
Journal of Molecular Modeling
|
September 25, 2012
Ion disturbance and clustering in the NaCl water solutions
Qiang Zhang, Xia Zhang, Dong-Xia Zhao
Journal of Computational Chemistry
|
December 16, 2011
Direct evaluation of individual hydrogen bond energy in situ in intra- and intermolecular multiple hydrogen bonds system
Cui Liu, Dong-Xia Zhao, Zhong-Zhi Yang
The Journal of Chemical Physics
|
July 23, 2004
Atom-bond electronegativity equalization method fused into molecular mechanics. I. A seven-site fluctuating charge and flexible body water potential function for water clusters
Zhong-Zhi Yang, Yang Wu, Dong-Xia Zhao
The Journal of Physical Chemistry. A
|
May 20, 2020
Partitioning a Molecule into the Atomic Basins and the Resultant Atomic Charges from Quantum Chemical Topology Analysis of the Kohn-Sham Potential
Dong-Xia Zhao, Jian Zhao, Zhong-Zhi Yang
The Journal of Chemical Physics
|
August 12, 2004
Polarization and bonding of the intrinsic characteristic contours of hydrogen and fluorine atoms of forming a hydrogen fluoride molecule based on an ab initio study
Zhong-Zhi Yang, Dong-Xia Zhao, Yang Wu
The Journal of Physical Chemistry. A
|
April 10, 2009
Theoretical analysis of gas-phase front-side attack identity S(N)2(C) and S(N)2(Si) reactions with retention of configuration
Zhong-Zhi Yang, Yan-Li Ding, Dong-Xia Zhao
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 22, 2008
Insight into markovnikov reactions of alkenes in terms of ab initio and molecular face theory
Zhong-Zhi Yang, Yan-Li Ding, Dong-Xia Zhao
The Journal of Physical Chemistry. A
|
June 30, 2025
Transition from Noncovalent Interaction to Covalent Bond Based on One-Electron Potential, Quantum Chemical Topology, and Molecular Face Theory
Xin-Meng Liu, Dong-Xia Zhao, Zhong-Zhi Yang
Page
of 4
Search research articles
Search
Showing results (1-10 of 35) with videos related to
Sort By:
Page
of 4
Journal of Computational Chemistry
|
March 12, 2014
Investigation of the distinction between van der Waals interaction and chemical bonding based on the PAEM-MO diagram
Dong-Xia Zhao, Zhong-Zhi Yang
The Journal of Physical Chemistry. A
|
August 12, 2014
Theoretical exploration of the potential and force acting on one electron within a molecule
Dong-Xia Zhao, Zhong-Zhi Yang
Journal of Molecular Modeling
|
September 25, 2012
Ion disturbance and clustering in the NaCl water solutions
Qiang Zhang, Xia Zhang, Dong-Xia Zhao
Journal of Computational Chemistry
|
December 16, 2011
Direct evaluation of individual hydrogen bond energy in situ in intra- and intermolecular multiple hydrogen bonds system
Cui Liu, Dong-Xia Zhao, Zhong-Zhi Yang
The Journal of Chemical Physics
|
July 23, 2004
Atom-bond electronegativity equalization method fused into molecular mechanics. I. A seven-site fluctuating charge and flexible body water potential function for water clusters
Zhong-Zhi Yang, Yang Wu, Dong-Xia Zhao
The Journal of Physical Chemistry. A
|
May 20, 2020
Partitioning a Molecule into the Atomic Basins and the Resultant Atomic Charges from Quantum Chemical Topology Analysis of the Kohn-Sham Potential
Dong-Xia Zhao, Jian Zhao, Zhong-Zhi Yang
The Journal of Chemical Physics
|
August 12, 2004
Polarization and bonding of the intrinsic characteristic contours of hydrogen and fluorine atoms of forming a hydrogen fluoride molecule based on an ab initio study
Zhong-Zhi Yang, Dong-Xia Zhao, Yang Wu
The Journal of Physical Chemistry. A
|
April 10, 2009
Theoretical analysis of gas-phase front-side attack identity S(N)2(C) and S(N)2(Si) reactions with retention of configuration
Zhong-Zhi Yang, Yan-Li Ding, Dong-Xia Zhao
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
October 22, 2008
Insight into markovnikov reactions of alkenes in terms of ab initio and molecular face theory
Zhong-Zhi Yang, Yan-Li Ding, Dong-Xia Zhao
The Journal of Physical Chemistry. A
|
June 30, 2025
Transition from Noncovalent Interaction to Covalent Bond Based on One-Electron Potential, Quantum Chemical Topology, and Molecular Face Theory
Xin-Meng Liu, Dong-Xia Zhao, Zhong-Zhi Yang
Page
of 4