Automatic generation of complementary auxiliary basis sets for explicitly correlated methods

Automatic generation of complementary auxiliary basis sets for explicitly correlated methods

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

Bibliographische Detailangaben
Veröffentlicht in:Journal of computational chemistry. - 1984. - 43(2022), 25 vom: 30. Sept., Seite 1690-1700
1. Verfasser: Semidalas, Emmanouil (VerfasserIn)
Weitere Verfasser: Martin, Jan M L
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2022
Zugriff auf das übergeordnete Werk:Journal of computational chemistry
Schlagworte:Journal Article Research Support, Non-U.S. Gov't automatic fitting basis set generation complementary auxiliary basis set explicitly correlated methods
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