A DFT Based Parameterization of the Vibronic Mixing between Two Non-degenerate Electronic States and the Application to s2-lone Pairs
Author:
Publisher
Elsevier
Reference26 articles.
1. Inorganic stereochemistry
2. Elektronendomänen und das VSEPR-Modell der Molekülgeometrie
3. Improving our understanding of molecular geometry and the VSEPR model through the ligand close-packing model and the analysis of electron density distributions
4. The electronic states of composite systems
Cited by 8 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. Pseudo-Jahn–Teller Effect—A Two-State Paradigm in Formation, Deformation, and Transformation of Molecular Systems and Solids;Chemical Reviews;2013-01-09
2. The theory-driven quest for a novel family of superconductors: fluorides;Journal of Materials Chemistry;2009
3. DFT-Based Studies on the Jahn−Teller Effect in 3d Hexacyanometalates with Orbitally Degenerate Ground States;The Journal of Physical Chemistry A;2007-08-24
4. The Stability and Eventual Lone Pair Distortion of the Hexahalide Complexes and Molecules of the Fifth to Eighth Main-Group Elements with One Lone Pair, as Isolated Entities or in Oligomeric Clusters: A Vibronic Coupling and DFT Study;Inorganic Chemistry;2005-06-17
5. Superconductivity: small steps towards the “grand unification”;Journal of Molecular Modeling;2005-05-12
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