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The Journal of Chemical Physics
|
April 22, 2019
Analytical energy gradients for ionized states using equation-of-motion coupled-cluster theory with spin-orbit coupling
Xiaojun Zhou, Zhanli Cao, Fan Wang
The Journal of Chemical Physics
|
October 27, 2016
Spin-orbit coupling with approximate equation-of-motion coupled-cluster method for ionization potential and electron attachment
Zhanli Cao, Fan Wang, Mingli Yang
The Journal of Chemical Physics
|
April 10, 2017
Coupled-cluster method for open-shell heavy-element systems with spin-orbit coupling
Zhanli Cao, Fan Wang, Mingli Yang
The Journal of Physical Chemistry. A
|
February 3, 2016
Spin-Orbit Effects in Closed-Shell Heavy and Superheavy Element Monohydrides and Monofluorides with Coupled-Cluster Theory
Dong-Dong Gao, Zhanli Cao, Fan Wang
Physical Chemistry Chemical Physics : PCCP
|
December 8, 2022
Barrier heights, reaction energies and bond dissociation energies for RH + HO<sub>2</sub> reactions with coupled-cluster theory, density functional theory and diffusion quantum Monte Carlo methods
Xiaojun Zhou, Zhanli Cao, Fan Wang, et al.
The Journal of Chemical Physics
|
February 3, 2018
Properties of closed-shell superheavy element hydrides and halides using coupled-cluster method and density functional theory with spin-orbit coupling
Minggang Guo, Zhanli Cao, Zhifan Wang, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 19, 2017
Combining the spin-separated exact two-component relativistic Hamiltonian with the equation-of-motion coupled-cluster method for the treatment of spin-orbit splittings of light and heavy elements
Zhanli Cao, Zhendong Li, Fan Wang, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
November 24, 2021
The effect of spin-orbit coupling on molecular properties: Potential energy curve, transition dipole moment and laser cooling scheme of NH
Yunguang Zhang, Qihao Wang, Simin Ni, et al.
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of 1
Search research articles
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Showing results (1-10 of 8) with videos related to
Sort By:
Page
of 1
The Journal of Chemical Physics
|
April 22, 2019
Analytical energy gradients for ionized states using equation-of-motion coupled-cluster theory with spin-orbit coupling
Xiaojun Zhou, Zhanli Cao, Fan Wang
The Journal of Chemical Physics
|
October 27, 2016
Spin-orbit coupling with approximate equation-of-motion coupled-cluster method for ionization potential and electron attachment
Zhanli Cao, Fan Wang, Mingli Yang
The Journal of Chemical Physics
|
April 10, 2017
Coupled-cluster method for open-shell heavy-element systems with spin-orbit coupling
Zhanli Cao, Fan Wang, Mingli Yang
The Journal of Physical Chemistry. A
|
February 3, 2016
Spin-Orbit Effects in Closed-Shell Heavy and Superheavy Element Monohydrides and Monofluorides with Coupled-Cluster Theory
Dong-Dong Gao, Zhanli Cao, Fan Wang
Physical Chemistry Chemical Physics : PCCP
|
December 8, 2022
Barrier heights, reaction energies and bond dissociation energies for RH + HO<sub>2</sub> reactions with coupled-cluster theory, density functional theory and diffusion quantum Monte Carlo methods
Xiaojun Zhou, Zhanli Cao, Fan Wang, et al.
The Journal of Chemical Physics
|
February 3, 2018
Properties of closed-shell superheavy element hydrides and halides using coupled-cluster method and density functional theory with spin-orbit coupling
Minggang Guo, Zhanli Cao, Zhifan Wang, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 19, 2017
Combining the spin-separated exact two-component relativistic Hamiltonian with the equation-of-motion coupled-cluster method for the treatment of spin-orbit splittings of light and heavy elements
Zhanli Cao, Zhendong Li, Fan Wang, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
November 24, 2021
The effect of spin-orbit coupling on molecular properties: Potential energy curve, transition dipole moment and laser cooling scheme of NH
Yunguang Zhang, Qihao Wang, Simin Ni, et al.
Page
of 1