Equilibrium properties of clusters in the harmonic superposition approximation

The inherent structure approach, or superposition approach is used to calculate some physical and chemical properties of clusters in thermodynamic equilibrium, for both the classical and quantum regimes. In the harmonic approximation some simple analytical estimates are obtained for the average pola...

Description complète

Détails bibliographiques
Auteurs principaux: Calvo, F, Doye, J, Wales, D
Format: Journal article
Langue:English
Publié: 2002