Computer simulations of the glass transition and glassy materials

We provide an overview of the different types of computational techniques developed over the years to study supercooled liquids, glassy materials and the physics of the glass transition. We organise these numerical strategies into four broad families. For each of them, we describe the general ideas...

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Main Authors: Barrat, Jean-Louis, Berthier, Ludovic
Format: Article
Language:English
Published: Académie des sciences 2023-04-01
Series:Comptes Rendus. Physique
Subjects:
Online Access:https://comptes-rendus.academie-sciences.fr/physique/articles/10.5802/crphys.129/
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author Barrat, Jean-Louis
Berthier, Ludovic
author_facet Barrat, Jean-Louis
Berthier, Ludovic
author_sort Barrat, Jean-Louis
collection DOAJ
description We provide an overview of the different types of computational techniques developed over the years to study supercooled liquids, glassy materials and the physics of the glass transition. We organise these numerical strategies into four broad families. For each of them, we describe the general ideas without discussing any technical details. We summarise the type of questions which can be addressed by any given approach and outline the main results which have been obtained. Finally we describe two important directions for future computational studies of glassy systems.
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spelling doaj.art-419be2bd50bd4817a8835bce7b1d6a232023-11-22T14:27:04ZengAcadémie des sciencesComptes Rendus. Physique1878-15352023-04-0111610.5802/crphys.12910.5802/crphys.129Computer simulations of the glass transition and glassy materialsBarrat, Jean-Louis0Berthier, Ludovic1https://orcid.org/0000-0003-2059-702XUniversité Grenoble Alpes, CNRS, LIPhy, 38000 Grenoble, FranceLaboratoire Charles Coulomb (L2C), Université de Montpellier, CNRS, 34095 Montpellier, France; Yusuf Hamied Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, United KingdomWe provide an overview of the different types of computational techniques developed over the years to study supercooled liquids, glassy materials and the physics of the glass transition. We organise these numerical strategies into four broad families. For each of them, we describe the general ideas without discussing any technical details. We summarise the type of questions which can be addressed by any given approach and outline the main results which have been obtained. Finally we describe two important directions for future computational studies of glassy systems.https://comptes-rendus.academie-sciences.fr/physique/articles/10.5802/crphys.129/glass transitioncomputer simulationamorphous solidssupercooled liquidsMonte Carlo methods
spellingShingle Barrat, Jean-Louis
Berthier, Ludovic
Computer simulations of the glass transition and glassy materials
Comptes Rendus. Physique
glass transition
computer simulation
amorphous solids
supercooled liquids
Monte Carlo methods
title Computer simulations of the glass transition and glassy materials
title_full Computer simulations of the glass transition and glassy materials
title_fullStr Computer simulations of the glass transition and glassy materials
title_full_unstemmed Computer simulations of the glass transition and glassy materials
title_short Computer simulations of the glass transition and glassy materials
title_sort computer simulations of the glass transition and glassy materials
topic glass transition
computer simulation
amorphous solids
supercooled liquids
Monte Carlo methods
url https://comptes-rendus.academie-sciences.fr/physique/articles/10.5802/crphys.129/
work_keys_str_mv AT barratjeanlouis computersimulationsoftheglasstransitionandglassymaterials
AT berthierludovic computersimulationsoftheglasstransitionandglassymaterials