An ab initio study of the structure and dynamics of bulk liquid Cd and its liquid-vapor interface.

Abstract

Several static and dynamic properties of bulk liquid Cd at a thermodynamic state near its triple point have been calculated by means of ab initio molecular dynamics simulations. The calculated static structure shows a very good agreement with the available experimental data. The dynamical structure reveals collective density excitations with an associated… (More)
DOI: 10.1088/0953-8984/25/6/065102

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