Nonlinear population analysis from geminal expansion of pair densities

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The nonlinear population analysis of pair densities introduced by one of us (R. B.) is reformulated using the geminal expansion of pair densities. The pair density in the geminal basis is idempotent and allows one to describe the bonding patterns as singlet‐and tripletlike contributions while still...

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Detalles Bibliográficos
Autor principal:	Bochicchio, Roberto Carlos
Publicado:	1995
Acceso en línea:	https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00207608_v54_n2_p99_Ponec http://hdl.handle.net/20.500.12110/paper_00207608_v54_n2_p99_Ponec
Aporte de:	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) de Universidad de Buenos Aires

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