Energy differences between density-functional-theory functional values for the near-exact and the Hartree-Fock densities by the line-integral method
Author:
Publisher
American Physical Society (APS)
Subject
Atomic and Molecular Physics, and Optics
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevA.58.1954/fulltext
Reference30 articles.
1. Energy expressions in density-functional theory using line integrals
2. Density-functional exchange-correlation potentials and orbital eigenvalues for light atoms
3. Exact exchange-only density functional theory by means of local scaling transformations
4. Local‐scaling transformations and the direct determination of Kohn–Sham orbitals and potentials for beryllium
5. QuantitiesTs[n] andTc[n] in density-functional theory
Cited by 7 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. Complete solution to the inverse Kohn-Sham problem: From the density to the energy;Physical Review C;2022-03-07
2. Inverting the external‐potential‐to‐electron density map in systems of electrons by minimization of a least‐squares fit functional for analytic potentials;International Journal of Quantum Chemistry;2019-09-10
3. The XYG3 type of doubly hybrid density functionals;WIREs Computational Molecular Science;2016-07-15
4. Reconstruction of Density Functionals from Kohn−Sham Potentials by Integration along Density Scaling Paths;Journal of Chemical Theory and Computation;2009-03-10
5. Efficient localized Hartree–Fock methods as effective exact-exchange Kohn–Sham methods for molecules;The Journal of Chemical Physics;2001-10
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