Global double hybrids do not work for charge transfer A comment on "Double hybrids and time-dependent density functional theory: An implementation and benchmark on charge transfer excited states"

Global double hybrids do not work for charge transfer : A comment on "Double hybrids and time-dependent density functional theory: An implementation and benchmark on charge transfer excited states"

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Détails bibliographiques
Publié dans:Journal of computational chemistry. - 1984. - 42(2021), 8 vom: 30. März, Seite 528-533
Auteur principal: Casanova-Páez, Marcos (Auteur)
Autres auteurs: Goerigk, Lars
Format: Article en ligne
Langue:English
Publié: 2021
Accès à la collection:Journal of computational chemistry
Sujets:Letter Research Support, Non-U.S. Gov't Comment TD-DFT charge-transfer excitations density functional theory double-hybrid density functionals range separation
Accès en ligne Volltext