Exact and exclusive electron localization indices within QTAIM atomic basins
Author:
Affiliation:
1. Department of Chemistry, Faculty of Natural and Agricultural Sciences; University of Pretoria, Lynnwood Road; Hatfield Pretoria 0002 South Africa
Funder
The National Research Foundation of South Africa
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Reference39 articles.
1. The Electron Pair in Chemistry
2. Spatial localization of the electronic pair and number distributions in molecules
3. Charge, bond order and valence in the AB initio SCF theory
4. Bond Multiplicity in Transition-Metal Complexes: Applications of Two-Electron Valence Indices
5. Natural resonance theory: II. Natural bond order and valency
Cited by 9 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. All‐body concept and quantified limits of cooperativity and related effects in homodromic cyclic water clusters from a molecular‐wide and electron density‐based approach;Journal of Computational Chemistry;2024-08-27
2. The Quantum Theory of Atoms in Molecules and Electron Localization and Delocalization;Lecture Notes in Chemistry;2024
3. Adsorption of antiretroviral drugs, efavirenz and nevirapine from aqueous solution by graphene wool: Kinetic, equilibrium, thermodynamic and computational studies;Applied Surface Science Advances;2021-12
4. A unified molecular‐wide and electron density based concept of chemical bonding;WIREs Computational Molecular Science;2021-10-15
5. The CH···HC interaction in biphenyl is a delocalized, molecular‐wide and entirely non‐classical interaction: Results from FALDI analysis;Journal of Computational Chemistry;2021-02-09
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