The reaction electronic flux in chemical reactions
Author:
Publisher
Springer Science and Business Media LLC
Subject
General Chemistry
Link
http://link.springer.com/content/pdf/10.1007/s11426-011-4447-z.pdf
Reference42 articles.
1. Fukui K. A formulation of the reaction coordinate. J Phys Chem, 1970, 74: 4161–4163
2. Fukui K. The path of chemical reactions—The IRC approach. Acc Chem Res, 1981, 14: 363–368
3. Gonzalez C, Schlegel HB. An improved algorithm for reaction path following. J Chem Phys, 1989, 90: 2154–2161
4. Toro-Labbé A. Characterization of chemical reactions from the profiles of energy, chemical potential, and hardness. J Phys Chem A, 1999, 103: 4398–4403
5. Jaque P, Toro-Labbé A. Theoretical study of the double proton transfer in the CHX-XH…CHX-XH (X = O, S) complexes. J Phys Chem A, 2000, 104: 995–1003
Cited by 57 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. On the link between the reaction force constant and conceptual DFT;Journal of Molecular Modeling;2024-09-14
2. The Role of Electronic Activity Toward the Analysis of Chemical Reactions;Electron Density;2024-07-05
3. Ab initio investigation on the mechanism of SO2 activation by P/B intermolecular frustrated Lewis pairs;Journal of Molecular Modeling;2024-07-02
4. Understanding the coupling of non-metallic heteroatoms to CO2 from a Conceptual DFT perspective;Journal of Molecular Modeling;2024-06-10
5. Basis Electronic Activity of Molecular Systems. A Theory of Bond Reactivity;The Journal of Physical Chemistry A;2024-03-04
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