Energy Renormalization for Coarse-Graining the Dynamics of a Model Glass-Forming Liquid
Abstract
Coarse-grained modeling achieves the enhanced computational efficiency required to model glass-forming materials by integrating out "unessential" molecular degrees of freedom, but no effective temperature transferable coarse-graining method currently exists to capture dynamics. We address this fundamental problem through an energy-renormalization scheme, in conjunction with the localization model of relaxation relating the Debye-Waller factor...
Paper Details
Title
Energy Renormalization for Coarse-Graining the Dynamics of a Model Glass-Forming Liquid
Published Date
Feb 5, 2018
Volume
122
Issue
6
Pages
2040 - 2045
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