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Free volume cannot explain the spatial heterogeneity of Debye–Waller factors in a glass-forming binary alloy

2005/11/29 by Asaph Widmer‐Cooper, Asaph Widmer-Cooper, Peter Harrowell · 2 citations
Materials Science · Physics and Astronomy · #Clay minerals and soil interactions #Material Dynamics and Properties #Theoretical and Computational Physics #cond-mat.dis-nn #cond-mat.soft #cond-mat.stat-mech

paper · pdf · doi:10.1016/j.jnoncrysol.2006.01.136

published as Journal of Non-Crystalline Solids 352 (2006) 5098-5102 · 18 pages, 5 figures

arxiv created 2005/11/29 · openalex publication_date 2006/08/25 · arxiv updated 2009/12/01 · openalex created_date 2025/10/10 · openalex updated_date 2026/07/28

Abstract

We examine the relation between the free volume per particle and the variance of the particle position, equivalent to a local Debye-Waller (DW) factor for a 2D glass-forming alloy using molecular dynamics simulations. We find that the latter quantity exhibits significant spatial heterogeneity despite involving trajectories two orders of magnitude shorter than those typically used to measure such heterogeneities. We find that the free volume exhibits no significant spatial correlation with the local DW factor. We conclude that the spatial variation in local free volume is not the cause of the short time dynamic heterogeneity.

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