Depicting electronic distributions from accurate computational first principles: On the relationship between the complex patterns of bonding interaction and the back-donation phenomenon-Reference-Cited by-同舟云学术

Depicting electronic distributions from accurate computational first principles: On the relationship between the complex patterns of bonding interaction and the back-donation phenomenon

Published:2016-09-07 Issue:24 Volume:116 Page:1851-1861
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int. J. Quantum Chem.

Author:

Lobayan Rosana M.¹,Bochicchio Roberto C.²,Pérez del Valle Carlos³

Affiliation:

1. Departamento de Física, Facultad de Ciencias Exactas; Naturales y Agrimensura Universidad Nacional del Nordeste; Corrientes 3400 Argentina

2. Departamento de Física, Facultad de Ciencias Exactas y Naturales; Universidad de Buenos Aires and IFIBA, CONICET, Ciudad Universitaria; Buenos Aires 1428 Argentina

3. Département de Chimie Moléculaire; Université Grenoble Alpes; Grenoble Cedex Grenoble F-38000 France

Funder

University of Buenos Aires

National Scientific and Technical Research Council

Secretaría General de Ciencia y Técnica de la Universidad Nacional del Nordeste

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Reference45 articles.

1. The role of single-particle density in chemistry

2. Reduced Density Matrices

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