Artículo

Reply to “Comment on ‘Depurated Inversion Method for Orbital‐Specific Exchange Potentials’”

Mitnik, Dario MarceloIcon ; Mendez, Marta Patricia AlejandraIcon ; Miraglia, Jorge EstebanIcon
Fecha de publicación: 02/2020
Editorial: John Wiley & Sons Inc.
Revista: International Journal of Quantum Chemistry
ISSN: 0020-7608
Idioma: Inglés
Tipo de recurso: Artículo publicado
Clasificación temática:

Resumen

The asymptotic behavior of Hartree-Fock orbitals has been studied by many authors since Handy, Marron and Silverstone (HMS) [1] demonstrated that at large distances r, the radial parts of the Hartree-Fock orbitals unl are controlled by the energy of the highest occupied molecular orbital ϵHOMO
Palabras clave: DEPURATED INVERSION METHOD , EXCHANGE POTENTIAL , HARTREE-FOCK WAVE FUNCTIONS , SPURIOUS NODES
 
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info:eu-repo/semantics/restrictedAccess Excepto donde se diga explícitamente, este item se publica bajo la siguiente descripción: Creative Commons Attribution-NonCommercial-ShareAlike 2.5 Unported (CC BY-NC-SA 2.5)
Identificadores
URI: http://hdl.handle.net/11336/151205
URL: https://onlinelibrary.wiley.com/doi/abs/10.1002/qua.26102
DOI: http://dx.doi.org/10.1002/qua.26102
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Articulos(IAFE)
Articulos de INST.DE ASTRONOMIA Y FISICA DEL ESPACIO(I)
Citación
Mitnik, Dario Marcelo; Mendez, Marta Patricia Alejandra; Miraglia, Jorge Esteban; Reply to “Comment on ‘Depurated Inversion Method for Orbital‐Specific Exchange Potentials’”; John Wiley & Sons Inc.; International Journal of Quantum Chemistry; 120; 4; 2-2020; 1-3
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