The one-electron picture in the Piris natural orbital functional 5 (PNOF5)
Author:
Publisher
Springer Science and Business Media LLC
Subject
Physical and Theoretical Chemistry
Link
http://link.springer.com/content/pdf/10.1007/s00214-012-1298-4.pdf
Reference58 articles.
1. Bent HA (1961) An Appraisal of Valence-bond Structures and Hybridization in Compounds of the First-row elements. Chem Rev 61(3):275–311
2. Brueckner KA, Wada W (1955) Nuclear saturation and two-body: self-consistent solutions and the effects of the exclusion principle. Phys Rev 103:1008–1016
3. Coulson CA, Longuet-Higgins HC (1947) The electronic structure of conjugated systems. I. General theory. Proc R Soc Lond A191:39–60
4. Day OW, Smith DW, Garrod C (1974) A generalization of the hartree-fock one-particle potential. Int J Quantum Chem Symp 8(S8):501–509
5. Day OW, Smith DW, Morrison RC (1975) Extension of Koopmans’ theorem. II. Accurate ionization energies from correlated wavefunctions for closed-shell atoms. J Chem Phys 62(1):115–119
Cited by 35 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. Advances in approximate natural orbital functionals: From historical perspectives to contemporary developments;Advances in Quantum Chemistry;2024
2. Correlation balance for describing carbenes: An NOF study;AIP Advances;2023-06-01
3. Natural orbital functional theory studies of all-metal aromaticity: The Al3−anion;Advances in Quantum Chemistry;2023
4. Coupled-cluster theory and chemical reactivity;Chemical Reactivity;2023
5. Electron Correlation in the Iron(II) Porphyrin by Natural Orbital Functional Approximations;Journal of Chemical Theory and Computation;2022-12-29
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