Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion

Autores
Zurman, Ayelen; Sarmoria, Claudia; Brandolin, Adriana; Asteasuain, Mariano
Año de publicación
2018
Idioma
inglés
Tipo de recurso
artículo
Estado
versión publicada
Descripción
In this work, we study the reverse atom transfer radical polymerization in miniemulsion using a water-soluble initiator. This study is motivated by the technological advantages of performing polymerizations in dispersed systems, and the attractive possibilities of controlled radical polymerization techniques to produce tailor made polymers. A mathematical model for this system is presented. The model predicts average molecular properties as well as the full molecular weight distribution (MWD) for different experimental conditions. The method of moments is applied for calculating average properties and the probability generating function (pgf) technique is used to model the MWD. The model is based on the mass balance equations of In this work, we study the reverse atom transfer radical polymerization in miniemulsion using a water-soluble initiator. This study is motivated by the technological advantages of performing polymerizations in dispersed systems, and the attractive possibilities of controlled radical polymerization techniques to produce tailor made polymers. A mathematical model for this system is presented. The model predicts average molecular properties as well as the full molecular weight distribution (MWD) for different experimental conditions. The method of moments is applied for calculating average properties and the probability generating function (pgf) technique is used to model the MWD. The model is based on the mass balance equations of the reacting species. It takes into account the reactions in both the aqueous and organic phases and the mass transfer between them. Predicted conversions, average molecular weights, polydispersity indexes and MWDs for different experimental conditions agree well with experimental data reported in the literature. reacting species. It takes into account the reactions in both the aqueous and organic phases and the mass transfer between them. Predicted conversions, average molecular weights, polydispersity indexes and MWDs for different experimental conditions agree well with experimental data reported in the literature.
Fil: Zurman, Ayelen. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina
Fil: Sarmoria, Claudia. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina. Universidad Nacional del Sur. Departamento de Ingeniería Química; Argentina
Fil: Brandolin, Adriana. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina. Universidad Nacional del Sur. Departamento de Ingeniería Química; Argentina
Fil: Asteasuain, Mariano. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina. Universidad Nacional del Sur. Departamento de Ingeniería Química; Argentina
Materia
REVERSE ATOM TRANSFER RADICAL POLYMERIZATION
MINIEMULSION
WATER-SOLUBLE INITIATOR
MOLECULAR WEIGHT DISTRIBUTION
MATHEMATICAL MODELING
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:11336/90918
Acceder
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oai_identifier_str oai:ri.conicet.gov.ar:11336/90918
network_acronym_str CONICETDig
repository_id_str 3498
network_name_str CONICET Digital (CONICET)
spelling Mathematical modeling of reverse atom transfer radical polymerization in miniemulsionZurman, AyelenSarmoria, ClaudiaBrandolin, AdrianaAsteasuain, MarianoREVERSE ATOM TRANSFER RADICAL POLYMERIZATIONMINIEMULSIONWATER-SOLUBLE INITIATORMOLECULAR WEIGHT DISTRIBUTIONMATHEMATICAL MODELINGhttps://purl.org/becyt/ford/2.4https://purl.org/becyt/ford/2In this work, we study the reverse atom transfer radical polymerization in miniemulsion using a water-soluble initiator. This study is motivated by the technological advantages of performing polymerizations in dispersed systems, and the attractive possibilities of controlled radical polymerization techniques to produce tailor made polymers. A mathematical model for this system is presented. The model predicts average molecular properties as well as the full molecular weight distribution (MWD) for different experimental conditions. The method of moments is applied for calculating average properties and the probability generating function (pgf) technique is used to model the MWD. The model is based on the mass balance equations of In this work, we study the reverse atom transfer radical polymerization in miniemulsion using a water-soluble initiator. This study is motivated by the technological advantages of performing polymerizations in dispersed systems, and the attractive possibilities of controlled radical polymerization techniques to produce tailor made polymers. A mathematical model for this system is presented. The model predicts average molecular properties as well as the full molecular weight distribution (MWD) for different experimental conditions. The method of moments is applied for calculating average properties and the probability generating function (pgf) technique is used to model the MWD. The model is based on the mass balance equations of the reacting species. It takes into account the reactions in both the aqueous and organic phases and the mass transfer between them. Predicted conversions, average molecular weights, polydispersity indexes and MWDs for different experimental conditions agree well with experimental data reported in the literature. reacting species. It takes into account the reactions in both the aqueous and organic phases and the mass transfer between them. Predicted conversions, average molecular weights, polydispersity indexes and MWDs for different experimental conditions agree well with experimental data reported in the literature.Fil: Zurman, Ayelen. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; ArgentinaFil: Sarmoria, Claudia. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina. Universidad Nacional del Sur. Departamento de Ingeniería Química; ArgentinaFil: Brandolin, Adriana. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina. Universidad Nacional del Sur. Departamento de Ingeniería Química; ArgentinaFil: Asteasuain, Mariano. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina. Universidad Nacional del Sur. Departamento de Ingeniería Química; ArgentinaElsevier2018-04-01info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionhttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdfapplication/pdfapplication/pdfapplication/pdfhttp://hdl.handle.net/11336/90918Zurman, Ayelen; Sarmoria, Claudia; Brandolin, Adriana; Asteasuain, Mariano; Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion; Elsevier; Computational Materials Science; 145; 1-4-2018; 48-590927-0256CONICET DigitalCONICETenginfo:eu-repo/semantics/altIdentifier/url/http://www.sciencedirect.com/science/article/pii/S0927025617307267info:eu-repo/semantics/altIdentifier/doi/10.1016/j.commatsci.2017.12.038info:eu-repo/semantics/openAccesshttps://creativecommons.org/licenses/by-nc-sa/2.5/ar/reponame:CONICET Digital (CONICET)instname:Consejo Nacional de Investigaciones Científicas y Técnicas2025-10-22T11:04:45Zoai:ri.conicet.gov.ar:11336/90918instacron: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 11:04:46.072CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicasfalse
dc.title.none.fl_str_mv Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion
title Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion
spellingShingle Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion
Zurman, Ayelen
REVERSE ATOM TRANSFER RADICAL POLYMERIZATION
MINIEMULSION
WATER-SOLUBLE INITIATOR
MOLECULAR WEIGHT DISTRIBUTION
MATHEMATICAL MODELING
title_short Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion
title_full Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion
title_fullStr Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion
title_full_unstemmed Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion
title_sort Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion
dc.creator.none.fl_str_mv Zurman, Ayelen
Sarmoria, Claudia
Brandolin, Adriana
Asteasuain, Mariano
author Zurman, Ayelen
author_facet Zurman, Ayelen
Sarmoria, Claudia
Brandolin, Adriana
Asteasuain, Mariano
author_role author
author2 Sarmoria, Claudia
Brandolin, Adriana
Asteasuain, Mariano
author2_role author
author
author
dc.subject.none.fl_str_mv REVERSE ATOM TRANSFER RADICAL POLYMERIZATION
MINIEMULSION
WATER-SOLUBLE INITIATOR
MOLECULAR WEIGHT DISTRIBUTION
MATHEMATICAL MODELING
topic REVERSE ATOM TRANSFER RADICAL POLYMERIZATION
MINIEMULSION
WATER-SOLUBLE INITIATOR
MOLECULAR WEIGHT DISTRIBUTION
MATHEMATICAL MODELING
purl_subject.fl_str_mv https://purl.org/becyt/ford/2.4
https://purl.org/becyt/ford/2
dc.description.none.fl_txt_mv In this work, we study the reverse atom transfer radical polymerization in miniemulsion using a water-soluble initiator. This study is motivated by the technological advantages of performing polymerizations in dispersed systems, and the attractive possibilities of controlled radical polymerization techniques to produce tailor made polymers. A mathematical model for this system is presented. The model predicts average molecular properties as well as the full molecular weight distribution (MWD) for different experimental conditions. The method of moments is applied for calculating average properties and the probability generating function (pgf) technique is used to model the MWD. The model is based on the mass balance equations of In this work, we study the reverse atom transfer radical polymerization in miniemulsion using a water-soluble initiator. This study is motivated by the technological advantages of performing polymerizations in dispersed systems, and the attractive possibilities of controlled radical polymerization techniques to produce tailor made polymers. A mathematical model for this system is presented. The model predicts average molecular properties as well as the full molecular weight distribution (MWD) for different experimental conditions. The method of moments is applied for calculating average properties and the probability generating function (pgf) technique is used to model the MWD. The model is based on the mass balance equations of the reacting species. It takes into account the reactions in both the aqueous and organic phases and the mass transfer between them. Predicted conversions, average molecular weights, polydispersity indexes and MWDs for different experimental conditions agree well with experimental data reported in the literature. reacting species. It takes into account the reactions in both the aqueous and organic phases and the mass transfer between them. Predicted conversions, average molecular weights, polydispersity indexes and MWDs for different experimental conditions agree well with experimental data reported in the literature.
Fil: Zurman, Ayelen. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina
Fil: Sarmoria, Claudia. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina. Universidad Nacional del Sur. Departamento de Ingeniería Química; Argentina
Fil: Brandolin, Adriana. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina. Universidad Nacional del Sur. Departamento de Ingeniería Química; Argentina
Fil: Asteasuain, Mariano. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Bahía Blanca. Planta Piloto de Ingeniería Química. Universidad Nacional del Sur. Planta Piloto de Ingeniería Química; Argentina. Universidad Nacional del Sur. Departamento de Ingeniería Química; Argentina
description In this work, we study the reverse atom transfer radical polymerization in miniemulsion using a water-soluble initiator. This study is motivated by the technological advantages of performing polymerizations in dispersed systems, and the attractive possibilities of controlled radical polymerization techniques to produce tailor made polymers. A mathematical model for this system is presented. The model predicts average molecular properties as well as the full molecular weight distribution (MWD) for different experimental conditions. The method of moments is applied for calculating average properties and the probability generating function (pgf) technique is used to model the MWD. The model is based on the mass balance equations of In this work, we study the reverse atom transfer radical polymerization in miniemulsion using a water-soluble initiator. This study is motivated by the technological advantages of performing polymerizations in dispersed systems, and the attractive possibilities of controlled radical polymerization techniques to produce tailor made polymers. A mathematical model for this system is presented. The model predicts average molecular properties as well as the full molecular weight distribution (MWD) for different experimental conditions. The method of moments is applied for calculating average properties and the probability generating function (pgf) technique is used to model the MWD. The model is based on the mass balance equations of the reacting species. It takes into account the reactions in both the aqueous and organic phases and the mass transfer between them. Predicted conversions, average molecular weights, polydispersity indexes and MWDs for different experimental conditions agree well with experimental data reported in the literature. reacting species. It takes into account the reactions in both the aqueous and organic phases and the mass transfer between them. Predicted conversions, average molecular weights, polydispersity indexes and MWDs for different experimental conditions agree well with experimental data reported in the literature.
publishDate 2018
dc.date.none.fl_str_mv 2018-04-01
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/11336/90918
Zurman, Ayelen; Sarmoria, Claudia; Brandolin, Adriana; Asteasuain, Mariano; Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion; Elsevier; Computational Materials Science; 145; 1-4-2018; 48-59
0927-0256
CONICET Digital
CONICET
url http://hdl.handle.net/11336/90918
identifier_str_mv Zurman, Ayelen; Sarmoria, Claudia; Brandolin, Adriana; Asteasuain, Mariano; Mathematical modeling of reverse atom transfer radical polymerization in miniemulsion; Elsevier; Computational Materials Science; 145; 1-4-2018; 48-59
0927-0256
CONICET Digital
CONICET
dc.language.none.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv info:eu-repo/semantics/altIdentifier/url/http://www.sciencedirect.com/science/article/pii/S0927025617307267
info:eu-repo/semantics/altIdentifier/doi/10.1016/j.commatsci.2017.12.038
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
application/pdf
application/pdf
dc.publisher.none.fl_str_mv Elsevier
publisher.none.fl_str_mv Elsevier
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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