Automatic generation of complementary auxiliary basis sets for explicitly correlated methods

© 2022 The Authors. Journal of Computational Chemistry published by Wiley Periodicals LLC.

Détails bibliographiques
Publié dans:Journal of computational chemistry. - 1984. - 43(2022), 25 vom: 30. Sept., Seite 1690-1700
Auteur principal: Semidalas, Emmanouil (Auteur)
Autres auteurs: Martin, Jan M L
Format: Article en ligne
Langue:English
Publié: 2022
Accès à la collection:Journal of computational chemistry
Sujets:Journal Article Research Support, Non-U.S. Gov't automatic fitting basis set generation complementary auxiliary basis set explicitly correlated methods