Toward deformation densities for intramolecular interactions without radical reference states using the fragment, atom, localized, delocalized, and interatomic (FALDI) charge density decomposition scheme

Toward deformation densities for intramolecular interactions without radical reference states using the fragment, atom, localized, delocalized, and interatomic (FALDI) charge density decomposition scheme

© 2017 Wiley Periodicals, Inc.

Bibliographische Detailangaben
Veröffentlicht in:Journal of computational chemistry. - 1984. - 38(2017), 13 vom: 15. Mai, Seite 981-997
1. Verfasser: de Lange, Jurgens Hendrik (VerfasserIn)
Weitere Verfasser: Cukrowski, Ignacy
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2017
Zugriff auf das übergeordnete Werk:Journal of computational chemistry
Schlagworte:Journal Article Research Support, Non-U.S. Gov't and interatomic atom computational chemistry deformation density delocalized domain averaged Fermi hole fragment intramolecular interactions localized
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