Calculation of improved enthalpy and entropy of vaporization by a modified partition function in quantum cluster equilibrium theory.

Zaby, Paul; Ingenmey, Johannes; Kirchner, Barbara; Grimme, Stefan; Ehlert, Sebastian

Zaby, Paul; Ingenmey, Johannes; Kirchner, Barbara; Grimme, Stefan; Ehlert, Sebastian.

Afiliación

Zaby P; Mulliken Center for Theoretical Chemistry, University of Bonn, Bonn, Germany.
Ingenmey J; Mulliken Center for Theoretical Chemistry, University of Bonn, Bonn, Germany.
Kirchner B; Mulliken Center for Theoretical Chemistry, University of Bonn, Bonn, Germany.
Grimme S; Mulliken Center for Theoretical Chemistry, University of Bonn, Bonn, Germany.
Ehlert S; Mulliken Center for Theoretical Chemistry, University of Bonn, Bonn, Germany.

J Chem Phys ; 155(10): 104101, 2021 Sep 14.

Article en En | MEDLINE | ID: mdl-34525835

Texto completo

Añadir a Mi BVS

Imprimir

XML

PubMed Links

Buscar en Google

Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: J Chem Phys Año: 2021 Tipo del documento: Article País de afiliación: Alemania Pais de publicación: Estados Unidos

Texto completo

Añadir a Mi BVS

Imprimir

XML

PubMed Links

Buscar en Google