Spin-orbit effects calculated by a configuration interaction method using determinants of two-component molecular spinors: test calculations on Rn and T1H-Reference-Cited by-同舟云学术

Spin-orbit effects calculated by a configuration interaction method using determinants of two-component molecular spinors: test calculations on Rn and T1H

Published:1996-05 Issue:3-4 Volume:253 Page:216-222
ISSN:0009-2614
Container-title:Chemical Physics Letters
language:en
Short-container-title:Chemical Physics Letters

Author:

Myeong Cheol Kim ,Sang Yeon Lee ,Yoon Sup Lee

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference34 articles.

1. Relativistic effects in structural chemistry

2. Spin-Orbit Coupling and Other Relativistic Effects in Atoms and Molecules

3. Relativity and chemical bonding

4. The concept of the chemical bond. Fundamentals of relativistic effects in chemistry;Schwarz,1990

5. Relativistic effects on Re and De in AgH and AuH from all‐electron Dirac–Hartree–Fock calculations

Cited by 27 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. The Study of $${\text{Br}}_{{\text{2}}}^{ + }$$ with Equation-of-Motion Coupled-Cluster Methods Including Spin-Orbit Coupling;Russian Journal of Physical Chemistry A;2024-03

2. Perspective: Simultaneous treatment of relativity, correlation, and QED;WIREs Computational Molecular Science;2022-12-22

3. SOiCI and iCISO: combining iterative configuration interaction with spin–orbit coupling in two ways;Journal of Physics: Condensed Matter;2022-04-01

4. Low-lying electronic states in thallium hydride with multireference configuration interaction calculation;Journal of Quantitative Spectroscopy and Radiative Transfer;2021-08

5. Coupled-cluster method for the electronic structure and spectroscopic constants in halohydride cations with spin–orbit coupling;Chemical Physics Letters;2021-06