An analysis of valence electronic structure from a viewpoint of resonance theory: Tautomerization of formamide and diazadiboretidine-Reference-Cited by-同舟云学术

An analysis of valence electronic structure from a viewpoint of resonance theory: Tautomerization of formamide and diazadiboretidine

Published:2021-06-10 Issue:23 Volume:42 Page:1662-1669
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J Comput Chem

Author:

Nakatani Kaho¹,Higashi Masahiro¹²^ORCID,Fukuda Ryoichi²^ORCID,Sato Hirofumi¹²³^ORCID

Affiliation:

1. Department of Molecular Engineering Kyoto University Kyoto Japan

2. Center for the Promotion of Interdisciplinary Education and Research, Elements Strategy Initiative for Catalysts and Batteries (ESICB) Kyoto University Kyoto Japan

3. Fukui Institute for Fundamental Chemistry Kyoto University Kyoto Japan

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.26703

Reference45 articles.

1. Canonical Configurational Interaction Procedure

2. Natural hybrid orbitals

3. Modern valence bond representations of CASSCF wavefunctions

4. Hückel-Lewis Projection Method: A “Weights Watcher” for Mesomeric Structures

5. The electronic structure of conjugated systems. VI

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