Ab Initio SCF Nonlinear Pair Population Analysis. A New Means of Detection and Localization of Multicenter Bonding-Reference-Cited by-同舟云学术

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Ab Initio SCF Nonlinear Pair Population Analysis. A New Means of Detection and Localization of Multicenter Bonding

Published:1997-11-01 Issue:23 Volume:36 Page:5363-5368
ISSN:0020-1669
Container-title:Inorganic Chemistry
language:en
Short-container-title:Inorg. Chem.

Author:

Bochicchio Roberto C.¹,Ponec Robert²,Uhlík Filip²

Affiliation:

1. Departamento de Física, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Ciudad Universitaria, 1428 Buenos Aires, Argentina

2. Institute of Chemical Process Fundamentals, Czech Academy of Sciences, Prague 6, Suchdol 2, 165 02 Czech Republic

Publisher

American Chemical Society (ACS)

Subject

Inorganic Chemistry,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ic961525o

Reference26 articles.

1. Theory of Valence in Progress; Kuznetsov, V. I., Ed.; Benjamin, Mir Publ. Moscow, 1980.

2. Electronic Population Analysis on LCAO–MO Molecular Wave Functions. I

3. Quantum theory of chemical valence concepts

4. Application of the pople-santry-segal CNDO method to the cyclopropylcarbinyl and cyclobutyl cation and to bicyclobutane

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3. Electronic Structure and Effectively Unpaired Electron Density Topology in closo-Boranes: Nonclassical Three-Center Two-Electron Bonding;Journal of Chemical Theory and Computation;2011-03-10

4. ChemInform Abstract: Ab initio SCF Nonlinear Pair Population Analysis. A New Means of Detection and Localization of Multicenter Bonding;ChemInform;2010-06-24

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