Structure and spin-purity conditions for reduced density matrices of arbitrary order
Author:
Publisher
Wiley
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics
Reference25 articles.
1. The density matrix in many-electron quantum mechanics II. Separation of space and spin variables; spin coupling problems
2. On the Origin of Spin‐Hamiltonian Parameters
3. Symmetry properties of natural orbitals and geminals I. Construction of spin- and symmetry-adapted functions
4. Über die Symmetrie-Eigenschaften der reduzierten Dichtematrizen und der natürlichen Spin-Orbitale und Spin-Geminale (der natürlichen Ein- und Zwei-Elektronen-Funktionen)
5. Notizen: Zur Schallfraktographie kleiner Bruchgeschwindigkeiten in Glas
Cited by 24 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. Accurate Prediction of Hyperfine Coupling Tensors for Main Group Elements Using a Unitary Group Based Rigorously Spin-Adapted Coupled-Cluster Theory;Journal of Chemical Theory and Computation;2019-01-30
2. Application of the unitary group approach to evaluate spin density for configuration interaction calculations in a basis of S 2 eigenfunctions;International Journal of Quantum Chemistry;2017-12-07
3. Simplified computations of spin excitations in high-spin carbon nanoclusters and related systems;Functional materials;2015-12-15
4. Communication: Spin densities within a unitary group based spin-adapted open-shell coupled-cluster theory: Analytic evaluation of isotropic hyperfine-coupling constants for the combinatoric open-shell coupled-cluster scheme;The Journal of Chemical Physics;2015-07-07
5. Zero field splitting of triplet levels of conjugated molecules: A comparison of exact and approximate π-schemes;Journal of Structural Chemistry;2013-02
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