Role of structure and entropy in determining differences in dynamics for glass formers with different interaction potentials

TitleRole of structure and entropy in determining differences in dynamics for glass formers with different interaction potentials
Publication TypeJournal Article
Year of Publication2014
AuthorsBanerjee, A, Sengupta, S, Sastry, S, Bhattacharyya, SMaitra
JournalPhysical Review Letters
Volume113
Issue22
Pagination225701
Date PublishedNOV
ISSN0031-9007
Abstract

We present a study of two model liquids with different interaction potentials, exhibiting similar structure but significantly different dynamics at low temperatures. By evaluating the configurational entropy, we show that the differences in the dynamics of these systems can be understood in terms of their thermodynamic differences. Analyzing their structure, we demonstrate that differences in pair correlation functions between the two systems, through their contribution to the entropy, dominate the differences in their dynamics, and indeed overestimate the differences. Including the contribution of higher order structural correlations to the entropy leads to smaller estimates for the relaxation times, as well as smaller differences between the two studied systems.

DOI10.1103/PhysRevLett.113.225701
Type of Journal (Indian or Foreign)

Foreign

Impact Factor (IF)

7.32

Divison category: 
Polymer Science & Engineering