An orbital localization criterion based on the topological analysis of the electron localization function at correlated level-Reference-Cited by-同舟云学术

An orbital localization criterion based on the topological analysis of the electron localization function at correlated level

Published:2018-02-06 Issue:14 Volume:118 Page:e25588
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int J Quantum Chem

Author:

Alcoba Diego R.¹²,Oña Ofelia B.³,Torre Alicia⁴^ORCID,Lain Luis⁴^ORCID,Tiznado William⁵^ORCID

Affiliation:

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

2. Instituto de Física de Buenos Aires, Consejo Nacional de Investigaciones Científicas y Técnicas. Ciudad Universitaria; 1428 Buenos Aires Argentina

3. Instituto de Investigaciones Fisicoquímicas Teóricas y Aplicadas, Universidad Nacional de La Plata, CCT La Plata, Consejo Nacional de Investigaciones Científicas y Técnicas. Diag. 113 y 64 (S/N), Sucursal 4, CC 16; 1900 La Plata Argentina

4. Departamento de Química Física; Facultad de Ciencia y Tecnología, Universidad del País Vasco, Apdo. 644; E-48080 Bilbao Spain

5. Departamento de Ciencias Químicas; Facultad de Ciencias Exactas, Universidad Andres Bello. Av. República 275; Santiago Chile

Funder

Agencia Nacional de Promoción Científica y Tecnológica

Universidad de Buenos Aires

Universidad del Pais Vasco

Consejo Nacional de Investigaciones Científicas y Técnicas

Publisher

Wiley

Subject

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

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/qua.25588/fullpdf

Reference54 articles.

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3. Canonical Configurational Interaction Procedure

4. Localized Atomic and Molecular Orbitals

5. Localized Atomic and Molecular Orbitals. II

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