Orbital structure of the Kohn-Sham exchange potential and exchange kernel and the field-counteracting potential for molecules in an electric field
Author:
Publisher
American Physical Society (APS)
Subject
Atomic and Molecular Physics, and Optics
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevA.64.042506/fulltext
Reference31 articles.
1. Self-Consistent Equations Including Exchange and Correlation Effects
2. Optimized effective atomic central potential
3. Exact Exchange Treatment for Molecules in Finite-Basis-Set Kohn-Sham Theory
4. Kohn-Sham potentials and wave functions from electron densities
5. New KS Method for Molecules Based on an Exchange Charge Density Generating the Exact Local KS Exchange Potential
Cited by 159 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. Single-Pole Polarization Models: Rapid Evaluation of Electron Affinities of Solvated-Electron and Superatomic Molecular Anionic States;The Journal of Physical Chemistry Letters;2024-01-26
2. Analytical Forces for the Optimized Effective Potential Calculations;Journal of Chemical Theory and Computation;2023-02-27
3. Physically meaningful solutions of optimized effective potential equations in a finite basis set within KS-DFT framework;Polish Quantum Chemistry from Kołos to Now;2023
4. Boosting the OEP2-sc method with spin-component scaling;Molecular Physics;2022-02-15
5. Numerically stable optimized effective potential method with standard Gaussian basis sets;The Journal of Chemical Physics;2021-08-07
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线，采集、加工和组织学术论文而形成的新型学术文献查询和分析系统，可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容，当前同舟云学术共收录了国内外主流学术期刊6万余种，收集的期刊论文及会议论文总量共计约1.5亿篇，并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询！咨询电话：010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3