The construction of symmetry-adapted functions in configuration interaction calculations for molecules with one principal axis of symmetry
Author:
Publisher
Wiley
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics
Reference21 articles.
1. Mathematical Problems in the Complete Quantum Predictions of Chemical Phenomena
2. C. M. Reeves 1957
3. Automatic Fundamental Calculations of Molecular Structure
4. S. F. Boys I. Shavitt 1959
Cited by 12 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. General method for symmetry orbitals and tensors in electronic structure calculations;Journal of Computational Chemistry;1999-02
2. AB-INITIO MODPOT/VRDDO/MERGE CALCULATIONS ON LARGE BIOMEDICAL MOLECULES AND ELECTROSTATIC MOLECULAR POTENTIAL CONTOUR MAPS;Annals of the New York Academy of Sciences;1981-05
3. Generation of generalized branching diagram spin functions by Schmidt orthogonalization of spin-paired functions;International Journal of Quantum Chemistry;1981-03
4. Spin dependent properties of perturbed wave functions: An analytic comparison of the exact, UHF, and spin‐projected UHF states;The Journal of Chemical Physics;1980-12-15
5. A genealogical electronic coupling procedure incorporating the Hartree–Fock interacting space and suitable for degenerate point groups. Application to excited states of BH3;The Journal of Chemical Physics;1980-07
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