New compact density matrix averaged ANO basis sets for relativistic calculations.

Widmark, Per-Olof; Zobel, J Patrick; Vysotskiy, Victor P; Tsuchiya, Takashi; Veryazov, Valera

Widmark, Per-Olof; Zobel, J Patrick; Vysotskiy, Victor P; Tsuchiya, Takashi; Veryazov, Valera.

Afiliación

Widmark PO; Division of Theoretical Chemistry, Kemicentrum, Lund University, P.O. Box 124, SE-221 00 Lund, Sweden.
Zobel JP; Division of Theoretical Chemistry, Kemicentrum, Lund University, P.O. Box 124, SE-221 00 Lund, Sweden.
Vysotskiy VP; Division of Theoretical Chemistry, Kemicentrum, Lund University, P.O. Box 124, SE-221 00 Lund, Sweden.
Tsuchiya T; Division of Theoretical Chemistry, Kemicentrum, Lund University, P.O. Box 124, SE-221 00 Lund, Sweden.
Veryazov V; Division of Theoretical Chemistry, Kemicentrum, Lund University, P.O. Box 124, SE-221 00 Lund, Sweden.

J Chem Phys ; 149(19): 194102, 2018 Nov 21.

Article en En | MEDLINE | ID: mdl-30466284

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Texto completo: 1 Colección: 01-internacional Banco de datos: MEDLINE Idioma: En Revista: J Chem Phys Año: 2018 Tipo del documento: Article País de afiliación: Suecia

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