The performance of density functional and wavefunction-based methods for 2D and 3D structures of Au10

The performance of density functional and wavefunction-based methods for 2D and 3D structures of Au10

© 2013 Wiley Periodicals, Inc.

Détails bibliographiques
Publié dans:Journal of computational chemistry. - 1984. - 34(2013), 23 vom: 05. Sept., Seite 1975-81
Auteur principal: Götz, Daniel A (Auteur)
Autres auteurs: Schäfer, Rolf, Schwerdtfeger, Peter
Format: Article en ligne
Langue:English
Publié: 2013
Accès à la collection:Journal of computational chemistry
Sujets:Journal Article Møller-Plesset perturbation theory gold clusters, structure and energetics • density functional theory • coupled cluster theory
Accès en ligne Volltext