Static and dynamic correlation lengths in supercooled polymers

Autores
Balbuena, Cristian; Gianetti, Melisa Mariel; Soulé, Ezequiel Rodolfo
Año de publicación
2019
Idioma
inglés
Tipo de recurso
artículo
Estado
versión publicada
Descripción
A key point to understand the glass transition is the relationship between structural and dynamic behavior experienced by a glass former when it approaches Tg. In this work, the relaxation in a simple bead-spring polymer system in the supercooled regime near its glass transition temperature was investigated with molecular dynamic simulations. We develop a new manner to look at the dynamic length scales in a supercooled polymeric system, focusing on correlated motion of particles in an isoconfigurational ensemble (that is, associated with the structure), as measured by Pearson’s correlation coefficient. We found that while the usual dynamic four-point correlation length deviates from the structural (mosaic or point-to-set) length scale at low temperatures, Pearson’s length behaves similarly to the static length in the whole temperature range. The results lead to a consensus of similar scaling of structural and dynamical length scales, reinforcing the idea of the theories of Adam-Gibbs and random first order transition.
Fil: Balbuena, Cristian. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Mar del Plata. Instituto de Investigaciones en Ciencia y Tecnología de Materiales. Universidad Nacional de Mar del Plata. Facultad de Ingeniería. Instituto de Investigaciones en Ciencia y Tecnología de Materiales; Argentina
Fil: Gianetti, Melisa Mariel. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Mar del Plata. Instituto de Investigaciones en Ciencia y Tecnología de Materiales. Universidad Nacional de Mar del Plata. Facultad de Ingeniería. Instituto de Investigaciones en Ciencia y Tecnología de Materiales; Argentina
Fil: Soulé, Ezequiel Rodolfo. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Mar del Plata. Instituto de Investigaciones en Ciencia y Tecnología de Materiales. Universidad Nacional de Mar del Plata. Facultad de Ingeniería. Instituto de Investigaciones en Ciencia y Tecnología de Materiales; Argentina
Materia
SUPERCOOLED POLYMER
DYNAMIC CORRELATION
STATIC CORRELATION
Nivel de accesibilidad
acceso abierto
Condiciones de uso
https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
Repositorio
CONICET Digital (CONICET)
Institución
Consejo Nacional de Investigaciones Científicas y Técnicas
OAI Identificador
oai:ri.conicet.gov.ar:11336/119232
Acceder
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network_name_str CONICET Digital (CONICET)
spelling Static and dynamic correlation lengths in supercooled polymersBalbuena, CristianGianetti, Melisa MarielSoulé, Ezequiel RodolfoSUPERCOOLED POLYMERDYNAMIC CORRELATIONSTATIC CORRELATIONhttps://purl.org/becyt/ford/2.5https://purl.org/becyt/ford/2A key point to understand the glass transition is the relationship between structural and dynamic behavior experienced by a glass former when it approaches Tg. In this work, the relaxation in a simple bead-spring polymer system in the supercooled regime near its glass transition temperature was investigated with molecular dynamic simulations. We develop a new manner to look at the dynamic length scales in a supercooled polymeric system, focusing on correlated motion of particles in an isoconfigurational ensemble (that is, associated with the structure), as measured by Pearson’s correlation coefficient. We found that while the usual dynamic four-point correlation length deviates from the structural (mosaic or point-to-set) length scale at low temperatures, Pearson’s length behaves similarly to the static length in the whole temperature range. The results lead to a consensus of similar scaling of structural and dynamical length scales, reinforcing the idea of the theories of Adam-Gibbs and random first order transition.Fil: Balbuena, Cristian. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Mar del Plata. Instituto de Investigaciones en Ciencia y Tecnología de Materiales. Universidad Nacional de Mar del Plata. Facultad de Ingeniería. Instituto de Investigaciones en Ciencia y Tecnología de Materiales; ArgentinaFil: Gianetti, Melisa Mariel. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Mar del Plata. Instituto de Investigaciones en Ciencia y Tecnología de Materiales. Universidad Nacional de Mar del Plata. Facultad de Ingeniería. Instituto de Investigaciones en Ciencia y Tecnología de Materiales; ArgentinaFil: Soulé, Ezequiel Rodolfo. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Mar del Plata. Instituto de Investigaciones en Ciencia y Tecnología de Materiales. Universidad Nacional de Mar del Plata. Facultad de Ingeniería. Instituto de Investigaciones en Ciencia y Tecnología de Materiales; ArgentinaAmerican Institute of Physics2019-05info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionhttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdfapplication/pdfhttp://hdl.handle.net/11336/119232Balbuena, Cristian; Gianetti, Melisa Mariel; Soulé, Ezequiel Rodolfo; Static and dynamic correlation lengths in supercooled polymers; American Institute of Physics; Journal of Chemical Physics; 150; 23; 5-2019; 2345080021-9606CONICET DigitalCONICETenginfo:eu-repo/semantics/altIdentifier/doi/10.1063/1.5091682info:eu-repo/semantics/altIdentifier/url/https://aip.scitation.org/doi/10.1063/1.5091682info:eu-repo/semantics/openAccesshttps://creativecommons.org/licenses/by-nc-sa/2.5/ar/reponame:CONICET Digital (CONICET)instname:Consejo Nacional de Investigaciones Científicas y Técnicas2025-10-22T12:02:03Zoai:ri.conicet.gov.ar:11336/119232instacron:CONICETInstitucionalhttp://ri.conicet.gov.ar/Organismo científico-tecnológicoNo correspondehttp://ri.conicet.gov.ar/oai/requestdasensio@conicet.gov.ar; lcarlino@conicet.gov.arArgentinaNo correspondeNo correspondeNo correspondeopendoar:34982025-10-22 12:02:03.671CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicasfalse
dc.title.none.fl_str_mv Static and dynamic correlation lengths in supercooled polymers
title Static and dynamic correlation lengths in supercooled polymers
spellingShingle Static and dynamic correlation lengths in supercooled polymers
Balbuena, Cristian
SUPERCOOLED POLYMER
DYNAMIC CORRELATION
STATIC CORRELATION
title_short Static and dynamic correlation lengths in supercooled polymers
title_full Static and dynamic correlation lengths in supercooled polymers
title_fullStr Static and dynamic correlation lengths in supercooled polymers
title_full_unstemmed Static and dynamic correlation lengths in supercooled polymers
title_sort Static and dynamic correlation lengths in supercooled polymers
dc.creator.none.fl_str_mv Balbuena, Cristian
Gianetti, Melisa Mariel
Soulé, Ezequiel Rodolfo
author Balbuena, Cristian
author_facet Balbuena, Cristian
Gianetti, Melisa Mariel
Soulé, Ezequiel Rodolfo
author_role author
author2 Gianetti, Melisa Mariel
Soulé, Ezequiel Rodolfo
author2_role author
author
dc.subject.none.fl_str_mv SUPERCOOLED POLYMER
DYNAMIC CORRELATION
STATIC CORRELATION
topic SUPERCOOLED POLYMER
DYNAMIC CORRELATION
STATIC CORRELATION
purl_subject.fl_str_mv https://purl.org/becyt/ford/2.5
https://purl.org/becyt/ford/2
dc.description.none.fl_txt_mv A key point to understand the glass transition is the relationship between structural and dynamic behavior experienced by a glass former when it approaches Tg. In this work, the relaxation in a simple bead-spring polymer system in the supercooled regime near its glass transition temperature was investigated with molecular dynamic simulations. We develop a new manner to look at the dynamic length scales in a supercooled polymeric system, focusing on correlated motion of particles in an isoconfigurational ensemble (that is, associated with the structure), as measured by Pearson’s correlation coefficient. We found that while the usual dynamic four-point correlation length deviates from the structural (mosaic or point-to-set) length scale at low temperatures, Pearson’s length behaves similarly to the static length in the whole temperature range. The results lead to a consensus of similar scaling of structural and dynamical length scales, reinforcing the idea of the theories of Adam-Gibbs and random first order transition.
Fil: Balbuena, Cristian. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Mar del Plata. Instituto de Investigaciones en Ciencia y Tecnología de Materiales. Universidad Nacional de Mar del Plata. Facultad de Ingeniería. Instituto de Investigaciones en Ciencia y Tecnología de Materiales; Argentina
Fil: Gianetti, Melisa Mariel. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Mar del Plata. Instituto de Investigaciones en Ciencia y Tecnología de Materiales. Universidad Nacional de Mar del Plata. Facultad de Ingeniería. Instituto de Investigaciones en Ciencia y Tecnología de Materiales; Argentina
Fil: Soulé, Ezequiel Rodolfo. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Mar del Plata. Instituto de Investigaciones en Ciencia y Tecnología de Materiales. Universidad Nacional de Mar del Plata. Facultad de Ingeniería. Instituto de Investigaciones en Ciencia y Tecnología de Materiales; Argentina
description A key point to understand the glass transition is the relationship between structural and dynamic behavior experienced by a glass former when it approaches Tg. In this work, the relaxation in a simple bead-spring polymer system in the supercooled regime near its glass transition temperature was investigated with molecular dynamic simulations. We develop a new manner to look at the dynamic length scales in a supercooled polymeric system, focusing on correlated motion of particles in an isoconfigurational ensemble (that is, associated with the structure), as measured by Pearson’s correlation coefficient. We found that while the usual dynamic four-point correlation length deviates from the structural (mosaic or point-to-set) length scale at low temperatures, Pearson’s length behaves similarly to the static length in the whole temperature range. The results lead to a consensus of similar scaling of structural and dynamical length scales, reinforcing the idea of the theories of Adam-Gibbs and random first order transition.
publishDate 2019
dc.date.none.fl_str_mv 2019-05
dc.type.none.fl_str_mv info:eu-repo/semantics/article
info:eu-repo/semantics/publishedVersion
http://purl.org/coar/resource_type/c_6501
info:ar-repo/semantics/articulo
format article
status_str publishedVersion
dc.identifier.none.fl_str_mv http://hdl.handle.net/11336/119232
Balbuena, Cristian; Gianetti, Melisa Mariel; Soulé, Ezequiel Rodolfo; Static and dynamic correlation lengths in supercooled polymers; American Institute of Physics; Journal of Chemical Physics; 150; 23; 5-2019; 234508
0021-9606
CONICET Digital
CONICET
url http://hdl.handle.net/11336/119232
identifier_str_mv Balbuena, Cristian; Gianetti, Melisa Mariel; Soulé, Ezequiel Rodolfo; Static and dynamic correlation lengths in supercooled polymers; American Institute of Physics; Journal of Chemical Physics; 150; 23; 5-2019; 234508
0021-9606
CONICET Digital
CONICET
dc.language.none.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv info:eu-repo/semantics/altIdentifier/doi/10.1063/1.5091682
info:eu-repo/semantics/altIdentifier/url/https://aip.scitation.org/doi/10.1063/1.5091682
dc.rights.none.fl_str_mv info:eu-repo/semantics/openAccess
https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
eu_rights_str_mv openAccess
rights_invalid_str_mv https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
dc.format.none.fl_str_mv application/pdf
application/pdf
dc.publisher.none.fl_str_mv American Institute of Physics
publisher.none.fl_str_mv American Institute of Physics
dc.source.none.fl_str_mv reponame:CONICET Digital (CONICET)
instname:Consejo Nacional de Investigaciones Científicas y Técnicas
reponame_str CONICET Digital (CONICET)
collection CONICET Digital (CONICET)
instname_str Consejo Nacional de Investigaciones Científicas y Técnicas
repository.name.fl_str_mv CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicas
repository.mail.fl_str_mv dasensio@conicet.gov.ar; lcarlino@conicet.gov.ar
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score 12.982451

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