Title of article :
A theoretical framework for calculations of the structural relaxation time on the basis of the free energy landscape theory
Author/Authors :
Ekimoto، نويسنده , , Toru and Yoshimori، نويسنده , , Akira and Odagaki، نويسنده , , Takashi and Yoshidome، نويسنده , , Takashi، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2013
Abstract :
On the basis of the free energy landscape theory, we develop a framework to calculate the structural relaxation time in supercooled liquids and glasses. By the framework, the relaxation time is obtained by an escaping time from a basin in a given free energy surface. In order to demonstrate its usefulness, we apply the framework to monodisperse hard-sphere glass systems. Then we show that the relaxation time increases drastically with the density. Additionally, we discuss an explicit picture of the cooperatively rearranging region by analyzing the spatial distribution of an activation free energy of one particle.
Journal title :
Chemical Physics Letters
Journal title :
Chemical Physics Letters