Brittle yielding in supercooled liquids below the critical temperature of mode coupling theory
Molecular Dynamics (MD) computer simulations of a polydisperse soft-sphere model under shear are presented. Starting point for these simulations are deeply supercooled samples far below the critical temperature, \(T_c\), of mode coupling theory. These samples are fully equilibrated with the aid of t...
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description | Molecular Dynamics (MD) computer simulations of a polydisperse soft-sphere model under shear are presented. Starting point for these simulations are deeply supercooled samples far below the critical temperature, \(T_c\), of mode coupling theory. These samples are fully equilibrated with the aid of the swap Monte Carlo technique. For states below \(T_c\), we identify a life time \(\tau_{\rm lt}\) that measures the time scale on which the system can be considered as an amorphous solid. The temperature dependence of \(\tau_{\rm lt}\) can be well described by an Arrhenius law. The existence of transient amorphous solid states below \(T_c\) is associated with the possibility of brittle yielding, as manifested by a sharp stress drop in the stress-strain relation and shear banding. We show that brittle yielding requires on the one hand low shear rates and on the other hand, the time scale corresponding to the inverse shear rate has to be smaller or of the order of \(\tau_{\rm lt}\). Both conditions can be only met for large life time \(\tau_{\rm lt}\), i.e.~for states far below \(T_c\). |
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Starting point for these simulations are deeply supercooled samples far below the critical temperature, \(T_c\), of mode coupling theory. These samples are fully equilibrated with the aid of the swap Monte Carlo technique. For states below \(T_c\), we identify a life time \(\tau_{\rm lt}\) that measures the time scale on which the system can be considered as an amorphous solid. The temperature dependence of \(\tau_{\rm lt}\) can be well described by an Arrhenius law. The existence of transient amorphous solid states below \(T_c\) is associated with the possibility of brittle yielding, as manifested by a sharp stress drop in the stress-strain relation and shear banding. We show that brittle yielding requires on the one hand low shear rates and on the other hand, the time scale corresponding to the inverse shear rate has to be smaller or of the order of \(\tau_{\rm lt}\). Both conditions can be only met for large life time \(\tau_{\rm lt}\), i.e.~for states far below \(T_c\).</description><identifier>EISSN: 2331-8422</identifier><identifier>DOI: 10.48550/arxiv.2202.12632</identifier><language>eng</language><publisher>Ithaca: Cornell University Library, arXiv.org</publisher><subject>Brittleness ; Coupled modes ; Coupling (molecular) ; Critical temperature ; Molecular dynamics ; Physics - Disordered Systems and Neural Networks ; Physics - Soft Condensed Matter ; Shear rate ; Stress-strain relationships ; Temperature dependence ; Time measurement ; Transition temperature</subject><ispartof>arXiv.org, 2022-02</ispartof><rights>2022. This work is published under http://creativecommons.org/licenses/by/4.0/ (the “License”). 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Both conditions can be only met for large life time \(\tau_{\rm lt}\), i.e.~for states far below \(T_c\).</description><subject>Brittleness</subject><subject>Coupled modes</subject><subject>Coupling (molecular)</subject><subject>Critical temperature</subject><subject>Molecular dynamics</subject><subject>Physics - Disordered Systems and Neural Networks</subject><subject>Physics - Soft Condensed Matter</subject><subject>Shear rate</subject><subject>Stress-strain relationships</subject><subject>Temperature dependence</subject><subject>Time measurement</subject><subject>Transition temperature</subject><issn>2331-8422</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2022</creationdate><recordtype>article</recordtype><sourceid>ABUWG</sourceid><sourceid>AFKRA</sourceid><sourceid>AZQEC</sourceid><sourceid>BENPR</sourceid><sourceid>CCPQU</sourceid><sourceid>DWQXO</sourceid><sourceid>GOX</sourceid><recordid>eNotkM1OwzAQhC0kJKrSB-CEJc4J9jpOkyNU_EmVuPRM5CRrcOXEqRMDeXvclr3sYb4dzQ4hN5ylWSElu1f-13ynAAxSDrmAC7IAIXhSZABXZDWOe8YY5GuQUizIx6M302SRzgZta_pPano6hgF945zFllpzCKYdaY3W_dDpC2kTL0yjLJ2wi5yagkfqNO1cG0UXBnu0iaTz8zW51MqOuPrfS7J7ftptXpPt-8vb5mGbKAk8QZZzjlphqbhuWs4AMpC8zvNalxDjNg2IWsfIkAmlpeRxJIiyZOsaslosye3Z9vR8NXjTKT9XxxKqUwmRuDsTg3eHgONU7V3wfcxURT2DomAFF3_L_1-m</recordid><startdate>20220225</startdate><enddate>20220225</enddate><creator>Lamp, Konstantin</creator><creator>Küchler, Niklas</creator><creator>Horbach, Jürgen</creator><general>Cornell University Library, arXiv.org</general><scope>8FE</scope><scope>8FG</scope><scope>ABJCF</scope><scope>ABUWG</scope><scope>AFKRA</scope><scope>AZQEC</scope><scope>BENPR</scope><scope>BGLVJ</scope><scope>CCPQU</scope><scope>DWQXO</scope><scope>HCIFZ</scope><scope>L6V</scope><scope>M7S</scope><scope>PIMPY</scope><scope>PQEST</scope><scope>PQQKQ</scope><scope>PQUKI</scope><scope>PRINS</scope><scope>PTHSS</scope><scope>GOX</scope></search><sort><creationdate>20220225</creationdate><title>Brittle yielding in supercooled liquids below the critical temperature of mode coupling theory</title><author>Lamp, Konstantin ; Küchler, Niklas ; Horbach, Jürgen</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-a521-e0611efae9a1fcd10224251b66bf92000cc23bf725243af5511115239907b24b3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2022</creationdate><topic>Brittleness</topic><topic>Coupled modes</topic><topic>Coupling (molecular)</topic><topic>Critical temperature</topic><topic>Molecular dynamics</topic><topic>Physics - Disordered Systems and Neural Networks</topic><topic>Physics - Soft Condensed Matter</topic><topic>Shear rate</topic><topic>Stress-strain relationships</topic><topic>Temperature dependence</topic><topic>Time measurement</topic><topic>Transition temperature</topic><toplevel>online_resources</toplevel><creatorcontrib>Lamp, Konstantin</creatorcontrib><creatorcontrib>Küchler, Niklas</creatorcontrib><creatorcontrib>Horbach, Jürgen</creatorcontrib><collection>ProQuest SciTech Collection</collection><collection>ProQuest Technology Collection</collection><collection>Materials Science & Engineering Collection</collection><collection>ProQuest Central (Alumni Edition)</collection><collection>ProQuest Central UK/Ireland</collection><collection>ProQuest Central Essentials</collection><collection>ProQuest Central</collection><collection>Technology Collection (ProQuest)</collection><collection>ProQuest One Community College</collection><collection>ProQuest Central Korea</collection><collection>SciTech Premium Collection</collection><collection>ProQuest Engineering Collection</collection><collection>Engineering Database</collection><collection>Publicly Available Content Database</collection><collection>ProQuest One Academic Eastern Edition (DO NOT USE)</collection><collection>ProQuest One Academic</collection><collection>ProQuest One Academic UKI Edition</collection><collection>ProQuest Central China</collection><collection>Engineering Collection</collection><collection>arXiv.org</collection><jtitle>arXiv.org</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Lamp, Konstantin</au><au>Küchler, Niklas</au><au>Horbach, Jürgen</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Brittle yielding in supercooled liquids below the critical temperature of mode coupling theory</atitle><jtitle>arXiv.org</jtitle><date>2022-02-25</date><risdate>2022</risdate><eissn>2331-8422</eissn><abstract>Molecular Dynamics (MD) computer simulations of a polydisperse soft-sphere model under shear are presented. Starting point for these simulations are deeply supercooled samples far below the critical temperature, \(T_c\), of mode coupling theory. These samples are fully equilibrated with the aid of the swap Monte Carlo technique. For states below \(T_c\), we identify a life time \(\tau_{\rm lt}\) that measures the time scale on which the system can be considered as an amorphous solid. The temperature dependence of \(\tau_{\rm lt}\) can be well described by an Arrhenius law. The existence of transient amorphous solid states below \(T_c\) is associated with the possibility of brittle yielding, as manifested by a sharp stress drop in the stress-strain relation and shear banding. We show that brittle yielding requires on the one hand low shear rates and on the other hand, the time scale corresponding to the inverse shear rate has to be smaller or of the order of \(\tau_{\rm lt}\). Both conditions can be only met for large life time \(\tau_{\rm lt}\), i.e.~for states far below \(T_c\).</abstract><cop>Ithaca</cop><pub>Cornell University Library, arXiv.org</pub><doi>10.48550/arxiv.2202.12632</doi><oa>free_for_read</oa></addata></record> |
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subjects | Brittleness Coupled modes Coupling (molecular) Critical temperature Molecular dynamics Physics - Disordered Systems and Neural Networks Physics - Soft Condensed Matter Shear rate Stress-strain relationships Temperature dependence Time measurement Transition temperature |
title | Brittle yielding in supercooled liquids below the critical temperature of mode coupling theory |
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