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Maximum Ionization in Restricted and Unrestricted Hartree-Fock Theory

In this paper, we investigate the maximum number of electrons that can be bound to a system of nuclei modelled by Hartree-Fock theory. We consider both the Restricted and Unrestricted Hartree-Fock models. We are taking a non-existence approach (necessary but not sufficient), in other words we are fi...

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Autors principals: Hazel Cox, Michael Melgaard, Ville J. J. Syrjanen
Format: Artigo
Idioma:Inglês
Publicat: MDPI AG 2021-02-01
Col·lecció:Atoms
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Accés en línia:https://www.mdpi.com/2218-2004/9/1/13
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