On the characterization of reaction paths by local descriptors: the behaviour of active BO sum and local information entropy along reaction paths and some consequences-Reference-Cited by-同舟云学术

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On the characterization of reaction paths by local descriptors: the behaviour of active BO sum and local information entropy along reaction paths and some consequences

Published:1996-09 Issue: Volume:367 Page:59-66
ISSN:0166-1280
Container-title:Journal of Molecular Structure: THEOCHEM
language:en
Short-container-title:Journal of Molecular Structure: THEOCHEM

Author:

Maity D.K.,Bhattacharyya S.P.

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry

Reference25 articles.

1. Bond orders from ab initio calculations and a test of the principle of bond order conservation

2. Valency changes in chemical reactions

3. Topological aspects of chemical reactivity. Valency changes in the course of chemical reactions

4. The behavior of quantum chemical bond order in the vicinity of a saddle point on the reaction path

5. A valence criterion for diradicals and zwitterions

Cited by 1 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. Bibliography;Molecular Descriptors for Chemoinformatics;2009-07-15

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