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Path Integrals for Electronic Densities, Reactivity Indices, and Localization Functions in Quantum Systems

The density matrix theory, the ancestor of density functional theory, provides the immediate framework for Path Integral (PI) development, allowing the canonical density be extended for the many-electronic systems through the density functional closure relationship. Yet, the use of path integral for...

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Autor principal: Putz, Mihai V.
Format: Artigo
Idioma:Inglês
Publicat: Molecular Diversity Preservation International (MDPI) 2009
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC2808013/
https://ncbi.nlm.nih.gov/pubmed/20087467
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms10114816
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