Computational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditions
Supervisor(es): Soares, Joao
Resumen:
This study simulates the free-radical copolymerization of acrylamide and acrylic acid. The simulations were carried out for different reactor configurations and thermal conditions. Moreover, the final copolymer microstructure was predicted by using mathematical simulations based on first principles. Although there are a great number of publications about the modelling of polymer reactions, this work aims to estimate the final copolymer microstructure at the end of conversion using a method with lower computational efforts. Those values will determine important properties, among others, physical and chemical behaviours in later copolymer applications. A study of how natural disturbances affect the copolymer properties has been analyzed too. Finally, a controller was implemented to control the temperature reaction as the input variable.
2020 | |
Agencia Nacional de Investigación e Innovación International Development Research Centre |
|
Copolymerization Process Control Computational Simulation Acrylamide Acrylic Acid Ingeniería y Tecnología Ingeniería Química Ingeniería de Procesos Químicos |
|
Inglés | |
Agencia Nacional de Investigación e Innovación | |
REDI | |
https://hdl.handle.net/20.500.12381/240 | |
Acceso abierto | |
Reconocimiento-SinObraDerivada 4.0 Internacional. (CC BY-ND) |
_version_ | 1814959262611275776 |
---|---|
author | Bugaiov Azurica, Diego A. |
author_facet | Bugaiov Azurica, Diego A. |
author_role | author |
bitstream.checksum.fl_str_mv | 2d97768b1a25a7df5a347bb58fd2d77f d962760458ac7ab2c442f881c61a9ab7 |
bitstream.checksumAlgorithm.fl_str_mv | MD5 MD5 |
bitstream.url.fl_str_mv | https://redi.anii.org.uy/jspui/bitstream/20.500.12381/240/2/license.txt https://redi.anii.org.uy/jspui/bitstream/20.500.12381/240/1/Capstone%20Report%20-%20Diego%20Bugaiov.pdf |
collection | REDI |
dc.creator.advisor.none.fl_str_mv | Soares, Joao |
dc.creator.none.fl_str_mv | Bugaiov Azurica, Diego A. |
dc.date.accessioned.none.fl_str_mv | 2020-06-15T17:41:37Z |
dc.date.available.none.fl_str_mv | 2020-06-15T17:41:37Z |
dc.date.issued.none.fl_str_mv | 2020-04-09 |
dc.description.abstract.none.fl_txt_mv | This study simulates the free-radical copolymerization of acrylamide and acrylic acid. The simulations were carried out for different reactor configurations and thermal conditions. Moreover, the final copolymer microstructure was predicted by using mathematical simulations based on first principles. Although there are a great number of publications about the modelling of polymer reactions, this work aims to estimate the final copolymer microstructure at the end of conversion using a method with lower computational efforts. Those values will determine important properties, among others, physical and chemical behaviours in later copolymer applications. A study of how natural disturbances affect the copolymer properties has been analyzed too. Finally, a controller was implemented to control the temperature reaction as the input variable. |
dc.description.sponsorship.none.fl_txt_mv | Agencia Nacional de Investigación e Innovación International Development Research Centre |
dc.identifier.anii.es.fl_str_mv | POS_IDRC_2018_1_152765 |
dc.identifier.uri.none.fl_str_mv | https://hdl.handle.net/20.500.12381/240 |
dc.language.iso.none.fl_str_mv | eng |
dc.publisher.es.fl_str_mv | University of Alberta |
dc.rights.es.fl_str_mv | Acceso abierto |
dc.rights.license.none.fl_str_mv | Reconocimiento-SinObraDerivada 4.0 Internacional. (CC BY-ND) |
dc.rights.none.fl_str_mv | info:eu-repo/semantics/openAccess |
dc.source.none.fl_str_mv | reponame:REDI instname:Agencia Nacional de Investigación e Innovación instacron:Agencia Nacional de Investigación e Innovación |
dc.subject.anii.es.fl_str_mv | Ingeniería y Tecnología Ingeniería Química Ingeniería de Procesos Químicos |
dc.subject.es.fl_str_mv | Copolymerization Process Control Computational Simulation Acrylamide Acrylic Acid |
dc.title.none.fl_str_mv | Computational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditions |
dc.type.es.fl_str_mv | Tesis de maestría |
dc.type.none.fl_str_mv | info:eu-repo/semantics/masterThesis |
dc.type.version.es.fl_str_mv | Aceptado |
dc.type.version.none.fl_str_mv | info:eu-repo/semantics/acceptedVersion |
description | This study simulates the free-radical copolymerization of acrylamide and acrylic acid. The simulations were carried out for different reactor configurations and thermal conditions. Moreover, the final copolymer microstructure was predicted by using mathematical simulations based on first principles. Although there are a great number of publications about the modelling of polymer reactions, this work aims to estimate the final copolymer microstructure at the end of conversion using a method with lower computational efforts. Those values will determine important properties, among others, physical and chemical behaviours in later copolymer applications. A study of how natural disturbances affect the copolymer properties has been analyzed too. Finally, a controller was implemented to control the temperature reaction as the input variable. |
eu_rights_str_mv | openAccess |
format | masterThesis |
id | REDI_defbcfb86e003f1518a14a8dd8e22a0a |
identifier_str_mv | POS_IDRC_2018_1_152765 |
instacron_str | Agencia Nacional de Investigación e Innovación |
institution | Agencia Nacional de Investigación e Innovación |
instname_str | Agencia Nacional de Investigación e Innovación |
language | eng |
network_acronym_str | REDI |
network_name_str | REDI |
oai_identifier_str | oai:redi.anii.org.uy:20.500.12381/240 |
publishDate | 2020 |
reponame_str | REDI |
repository.mail.fl_str_mv | jmaldini@anii.org.uy |
repository.name.fl_str_mv | REDI - Agencia Nacional de Investigación e Innovación |
repository_id_str | 9421 |
rights_invalid_str_mv | Reconocimiento-SinObraDerivada 4.0 Internacional. (CC BY-ND) Acceso abierto |
spelling | Reconocimiento-SinObraDerivada 4.0 Internacional. (CC BY-ND)Acceso abiertoinfo:eu-repo/semantics/openAccess2020-06-15T17:41:37Z2020-06-15T17:41:37Z2020-04-09https://hdl.handle.net/20.500.12381/240POS_IDRC_2018_1_152765This study simulates the free-radical copolymerization of acrylamide and acrylic acid. The simulations were carried out for different reactor configurations and thermal conditions. Moreover, the final copolymer microstructure was predicted by using mathematical simulations based on first principles. Although there are a great number of publications about the modelling of polymer reactions, this work aims to estimate the final copolymer microstructure at the end of conversion using a method with lower computational efforts. Those values will determine important properties, among others, physical and chemical behaviours in later copolymer applications. A study of how natural disturbances affect the copolymer properties has been analyzed too. Finally, a controller was implemented to control the temperature reaction as the input variable.Agencia Nacional de Investigación e InnovaciónInternational Development Research CentreengUniversity of AlbertaCopolymerizationProcess ControlComputational SimulationAcrylamideAcrylic AcidIngeniería y TecnologíaIngeniería QuímicaIngeniería de Procesos QuímicosComputational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditionsTesis de maestríaAceptadoinfo:eu-repo/semantics/acceptedVersioninfo:eu-repo/semantics/masterThesisreponame:REDIinstname:Agencia Nacional de Investigación e Innovacióninstacron:Agencia Nacional de Investigación e InnovaciónBugaiov Azurica, Diego A.Soares, JoaoLICENSElicense.txtlicense.txttext/plain; charset=utf-84746https://redi.anii.org.uy/jspui/bitstream/20.500.12381/240/2/license.txt2d97768b1a25a7df5a347bb58fd2d77fMD52ORIGINALCapstone Report - Diego Bugaiov.pdfCapstone Report - Diego Bugaiov.pdfapplication/pdf3051476https://redi.anii.org.uy/jspui/bitstream/20.500.12381/240/1/Capstone%20Report%20-%20Diego%20Bugaiov.pdfd962760458ac7ab2c442f881c61a9ab7MD5120.500.12381/2402020-09-18 12:20:11.302oai:redi.anii.org.uy:20.500.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://www.anii.org.uy/https://redi.anii.org.uy/oai/requestjmaldini@anii.org.uyUruguayopendoar:94212020-09-18T15:20:11REDI - Agencia Nacional de Investigación e Innovaciónfalse |
spellingShingle | Computational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditions Bugaiov Azurica, Diego A. Copolymerization Process Control Computational Simulation Acrylamide Acrylic Acid Ingeniería y Tecnología Ingeniería Química Ingeniería de Procesos Químicos |
status_str | acceptedVersion |
title | Computational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditions |
title_full | Computational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditions |
title_fullStr | Computational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditions |
title_full_unstemmed | Computational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditions |
title_short | Computational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditions |
title_sort | Computational simulation of Acrylamide and Acrylic Acid reaction by free-radical copolymerization in different reactor configurations and thermal conditions |
topic | Copolymerization Process Control Computational Simulation Acrylamide Acrylic Acid Ingeniería y Tecnología Ingeniería Química Ingeniería de Procesos Químicos |
url | https://hdl.handle.net/20.500.12381/240 |