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Autori principali: Lang, Danqi, Scalliet, Camille, Royall, C. Patrick
Natura: Preprint
Pubblicazione: 2024
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Accesso online:https://arxiv.org/abs/2408.12738
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author Lang, Danqi
Scalliet, Camille
Royall, C. Patrick
author_facet Lang, Danqi
Scalliet, Camille
Royall, C. Patrick
contents Dynamics that are microscopic in space and time, in which particles commit to a position, so-called excitations, are considered the elementary unit of relaxation in the Dynamic Facilitation (DF) theory of the glass transition. Meanwhile, geometric motifs known as locally favored structures (LFS) are associated with vitrification in many glassformers. Recent work indicates that the probability of particles found both in locally favored structures (LFS) and excitations decreases significantly upon supercooling suggesting that there is an anti-correlation between them [Ortlieb et al, Nature Commun. 14, 2621 (2023)]. However, the spatial relationship between excitations and LFS remains unclear. By employing state-of-the-art GPU computer simulations and colloid experiments, we analyze this relationship between LFS and excitations in model glassformers. We demonstrate that there is a spatial separation between the two in deeply supercooled liquids. This may be due to the fact that LFS are well-packed, thus they are relatively stable.
format Preprint
id arxiv_https___arxiv_org_abs_2408_12738
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Anti-correlation between excitations and locally-favored structures in glass-forming systems
Lang, Danqi
Scalliet, Camille
Royall, C. Patrick
Soft Condensed Matter
Applied Physics
Computational Physics
Dynamics that are microscopic in space and time, in which particles commit to a position, so-called excitations, are considered the elementary unit of relaxation in the Dynamic Facilitation (DF) theory of the glass transition. Meanwhile, geometric motifs known as locally favored structures (LFS) are associated with vitrification in many glassformers. Recent work indicates that the probability of particles found both in locally favored structures (LFS) and excitations decreases significantly upon supercooling suggesting that there is an anti-correlation between them [Ortlieb et al, Nature Commun. 14, 2621 (2023)]. However, the spatial relationship between excitations and LFS remains unclear. By employing state-of-the-art GPU computer simulations and colloid experiments, we analyze this relationship between LFS and excitations in model glassformers. We demonstrate that there is a spatial separation between the two in deeply supercooled liquids. This may be due to the fact that LFS are well-packed, thus they are relatively stable.
title Anti-correlation between excitations and locally-favored structures in glass-forming systems
topic Soft Condensed Matter
Applied Physics
Computational Physics
url https://arxiv.org/abs/2408.12738