Solid-fluid equilibrium: new perspectives from molecular theory

Autor: Carlos Vega, P.A. Monson, E.P.A. Paras, X. Cottin
Rok vydání: 1996
Předmět:
Zdroj: Fluid Phase Equilibria. 117:114-125
ISSN: 0378-3812
DOI: 10.1016/0378-3812(95)02944-3
Popis: Some recent developments in the molecular modeling of solid-fluid phase equilibrium are reviewed. Theoretical approches to solid phase thermodynamics and solid-fluid equilbria are described as well as methods for studying solid phases by computer simulation. Applications to the study of solid-fluid equilibrium in systems of nonspherical molecules and to predicting solid-fluid phase diagrams for mixtures are described.
Databáze: OpenAIRE