FCIQMC-Tailored Distinguishable Cluster Approach: Open-Shell Systems.

Vitale, Eugenio; Li Manni, Giovanni; Alavi, Ali; Kats, Daniel.

Afiliação

Vitale E; Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart, Germany.
Li Manni G; Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart, Germany.
Alavi A; Max Planck Institute for Solid State Research, Heisenbergstraße 1, 70569 Stuttgart, Germany.
Kats D; Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, United Kingdom.

J Chem Theory Comput ; 18(6): 3427-3437, 2022 Jun 14.

Article em En | MEDLINE | ID: mdl-35522217

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2022 Tipo de documento: Article

Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2022 Tipo de documento: Article