Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic Modeling

Detalhes bibliográficos
Autor(a) principal: Bacicheti, Jacqueline Mansano Ortega
Data de Publicação: 2022
Outros Autores: Oliveira, José Augusto [UNESP], Barros, Thiago Vinicius, Ferreira-Pinto, Leandro [UNESP], Castillo, Pedro Felipe Arce, Cabral, Vladimir Ferreira, Cardozo-Filho, Lucio [UNESP]
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Repositório Institucional da UNESP
Texto Completo: http://dx.doi.org/10.1007/s10953-022-01196-6
http://hdl.handle.net/11449/240701
Resumo: Dimethyl sulfoxide (DMSO) and acetone are frequently used in supercritical antisolvent (SAS) processes, since they have very different physical properties and have complex phase behavior. This paper reports experimental phase equilibrium data for {CO2 + DMSO} and {CO2 + acetone + DMSO} systems. The static synthetic method was employed to obtain phase equilibrium behavior in pressures up to 12.1 MPa, temperature range between 313.15 and 343.15 K, the concentration of 5.5 mol·kg−1 (solute: DMSO; solvent: acetone) on a CO2-free basis, and CO2 mole fractions between 0.652 and 0.953. The experimental data measured here presented transitions of VLE (vapor–liquid equilibrium) and LLE (liquid–liquid equilibrium) phases. In this work, the effects of association between molecules are considered. Thus, the PC-SAFT EoS was used to model the experimental data and phase transitions, and the pressure deviation between experimental and calculated data for the binary and ternary system was 0.81% and 0.51%, respectively. The percentage average absolute relative deviation (%AARD) for {CO2 + DMSO}, {CO2 + acetone} and {DMSO + acetone} system was 0.57, 0.89 and 0.29, respectively.
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spelling Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic ModelingAcetoneCO2DMSOPC-SAFTPhase equilibriumSupercritical antisolvent processDimethyl sulfoxide (DMSO) and acetone are frequently used in supercritical antisolvent (SAS) processes, since they have very different physical properties and have complex phase behavior. This paper reports experimental phase equilibrium data for {CO2 + DMSO} and {CO2 + acetone + DMSO} systems. The static synthetic method was employed to obtain phase equilibrium behavior in pressures up to 12.1 MPa, temperature range between 313.15 and 343.15 K, the concentration of 5.5 mol·kg−1 (solute: DMSO; solvent: acetone) on a CO2-free basis, and CO2 mole fractions between 0.652 and 0.953. The experimental data measured here presented transitions of VLE (vapor–liquid equilibrium) and LLE (liquid–liquid equilibrium) phases. In this work, the effects of association between molecules are considered. Thus, the PC-SAFT EoS was used to model the experimental data and phase transitions, and the pressure deviation between experimental and calculated data for the binary and ternary system was 0.81% and 0.51%, respectively. The percentage average absolute relative deviation (%AARD) for {CO2 + DMSO}, {CO2 + acetone} and {DMSO + acetone} system was 0.57, 0.89 and 0.29, respectively.Chemical Engineering Department State University of Maringá, PRSão Paulo State University (UNESP), Campus of São João da Boa VistaEnergy Engineering Department Sao Paulo State University (UNESP), SPChemical Engineering Department Engineering School of Lorena University of São Paulo, SPSão Paulo State University (UNESP), Campus of São João da Boa VistaEnergy Engineering Department Sao Paulo State University (UNESP), SPState University of MaringáUniversidade Estadual Paulista (UNESP)Universidade de São Paulo (USP)Bacicheti, Jacqueline Mansano OrtegaOliveira, José Augusto [UNESP]Barros, Thiago ViniciusFerreira-Pinto, Leandro [UNESP]Castillo, Pedro Felipe ArceCabral, Vladimir FerreiraCardozo-Filho, Lucio [UNESP]2023-03-01T20:29:03Z2023-03-01T20:29:03Z2022-01-01info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articlehttp://dx.doi.org/10.1007/s10953-022-01196-6Journal of Solution Chemistry.1572-89270095-9782http://hdl.handle.net/11449/24070110.1007/s10953-022-01196-62-s2.0-85136575579Scopusreponame:Repositório Institucional da UNESPinstname:Universidade Estadual Paulista (UNESP)instacron:UNESPengJournal of Solution Chemistryinfo:eu-repo/semantics/openAccess2023-03-01T20:29:03Zoai:repositorio.unesp.br:11449/240701Repositório InstitucionalPUBhttp://repositorio.unesp.br/oai/requestopendoar:29462024-08-05T14:07:51.372294Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP)false
dc.title.none.fl_str_mv Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic Modeling
title Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic Modeling
spellingShingle Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic Modeling
Bacicheti, Jacqueline Mansano Ortega
Acetone
CO2
DMSO
PC-SAFT
Phase equilibrium
Supercritical antisolvent process
title_short Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic Modeling
title_full Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic Modeling
title_fullStr Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic Modeling
title_full_unstemmed Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic Modeling
title_sort Phase Equilibria of {Carbon Dioxide + Acetone + Dimethyl Sulfoxide} Systems: Experimental Data and Thermodynamic Modeling
author Bacicheti, Jacqueline Mansano Ortega
author_facet Bacicheti, Jacqueline Mansano Ortega
Oliveira, José Augusto [UNESP]
Barros, Thiago Vinicius
Ferreira-Pinto, Leandro [UNESP]
Castillo, Pedro Felipe Arce
Cabral, Vladimir Ferreira
Cardozo-Filho, Lucio [UNESP]
author_role author
author2 Oliveira, José Augusto [UNESP]
Barros, Thiago Vinicius
Ferreira-Pinto, Leandro [UNESP]
Castillo, Pedro Felipe Arce
Cabral, Vladimir Ferreira
Cardozo-Filho, Lucio [UNESP]
author2_role author
author
author
author
author
author
dc.contributor.none.fl_str_mv State University of Maringá
Universidade Estadual Paulista (UNESP)
Universidade de São Paulo (USP)
dc.contributor.author.fl_str_mv Bacicheti, Jacqueline Mansano Ortega
Oliveira, José Augusto [UNESP]
Barros, Thiago Vinicius
Ferreira-Pinto, Leandro [UNESP]
Castillo, Pedro Felipe Arce
Cabral, Vladimir Ferreira
Cardozo-Filho, Lucio [UNESP]
dc.subject.por.fl_str_mv Acetone
CO2
DMSO
PC-SAFT
Phase equilibrium
Supercritical antisolvent process
topic Acetone
CO2
DMSO
PC-SAFT
Phase equilibrium
Supercritical antisolvent process
description Dimethyl sulfoxide (DMSO) and acetone are frequently used in supercritical antisolvent (SAS) processes, since they have very different physical properties and have complex phase behavior. This paper reports experimental phase equilibrium data for {CO2 + DMSO} and {CO2 + acetone + DMSO} systems. The static synthetic method was employed to obtain phase equilibrium behavior in pressures up to 12.1 MPa, temperature range between 313.15 and 343.15 K, the concentration of 5.5 mol·kg−1 (solute: DMSO; solvent: acetone) on a CO2-free basis, and CO2 mole fractions between 0.652 and 0.953. The experimental data measured here presented transitions of VLE (vapor–liquid equilibrium) and LLE (liquid–liquid equilibrium) phases. In this work, the effects of association between molecules are considered. Thus, the PC-SAFT EoS was used to model the experimental data and phase transitions, and the pressure deviation between experimental and calculated data for the binary and ternary system was 0.81% and 0.51%, respectively. The percentage average absolute relative deviation (%AARD) for {CO2 + DMSO}, {CO2 + acetone} and {DMSO + acetone} system was 0.57, 0.89 and 0.29, respectively.
publishDate 2022
dc.date.none.fl_str_mv 2022-01-01
2023-03-01T20:29:03Z
2023-03-01T20:29:03Z
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv http://dx.doi.org/10.1007/s10953-022-01196-6
Journal of Solution Chemistry.
1572-8927
0095-9782
http://hdl.handle.net/11449/240701
10.1007/s10953-022-01196-6
2-s2.0-85136575579
url http://dx.doi.org/10.1007/s10953-022-01196-6
http://hdl.handle.net/11449/240701
identifier_str_mv Journal of Solution Chemistry.
1572-8927
0095-9782
10.1007/s10953-022-01196-6
2-s2.0-85136575579
dc.language.iso.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv Journal of Solution Chemistry
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.source.none.fl_str_mv Scopus
reponame:Repositório Institucional da UNESP
instname:Universidade Estadual Paulista (UNESP)
instacron:UNESP
instname_str Universidade Estadual Paulista (UNESP)
instacron_str UNESP
institution UNESP
reponame_str Repositório Institucional da UNESP
collection Repositório Institucional da UNESP
repository.name.fl_str_mv Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP)
repository.mail.fl_str_mv
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