Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series
- Autores
- Espinosa, Susana; Raeissi, S.; Brignole, Esteban Alberto; Peters, Cornelis J.
- Año de publicación
- 2004
- Idioma
- inglés
- Tipo de recurso
- artículo
- Estado
- versión publicada
- Descripción
- The phenomenon of double retrograde vaporization (DRV) has been simulated using the group contribution equation of state coupled with the Michelsen computational procedures for calculating phase envelopes. This behavior was studied for a number of binary mixtures of near critical fluids with a low volatile component. For the binary systems ethane+limonene, ethane+linalool, methane+butane, and methane+pentane the "double-domed" and "S" shaped curves were successfully predicted and found to be in good agreement with the experimental information available. Prediction of DRV in a number of binary systems from different families further confirmed the idea of the generality of this behavior in all asymmetric mixtures. All results indicate that as the solute increases in molecular size, the composition at which the phenomenon of DRV starts to appear shifts to higher solvent concentration, while simultaneously covering a wider composition range. For the homologous n-alkane series in binary mixtures with C1 up to C5 as near-critical solvents, a correlation in the appearance of the phenomenon of DRV with the hard-sphere diameter of the solvent was observed. Although for each solvent, the lower limit of solute carbon number that shows DRV is easily estimated, the upper carbon number could not always be determined because the occurrence of liquid-liquid immiscibility interferes with the DRV phenomenon. In binary mixtures of CO2 with homologous members of alkyl esters, no liquid-liquid immiscibility was predicted, so it was possible to determine both the lower and upper concentration bounds of DRV.
Fil: Espinosa, Susana. 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: Raeissi, S.. Delft University of Technology; Países Bajos
Fil: Brignole, Esteban Alberto. 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: Peters, Cornelis J.. Delft University of Technology; Países Bajos - Materia
-
ALKANES
DILUTE
GROUP CONTRIBUTION
PHASE BEHAVIOR
RETROGRADE CONDENSATION
SIMULATION
SUPERCRITICAL - Nivel de accesibilidad
- acceso abierto
- Condiciones de uso
- https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
- Repositorio
- Institución
- Consejo Nacional de Investigaciones Científicas y Técnicas
- OAI Identificador
- oai:ri.conicet.gov.ar:11336/97829
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Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous seriesEspinosa, SusanaRaeissi, S.Brignole, Esteban AlbertoPeters, Cornelis J.ALKANESDILUTEGROUP CONTRIBUTIONPHASE BEHAVIORRETROGRADE CONDENSATIONSIMULATIONSUPERCRITICALhttps://purl.org/becyt/ford/2.4https://purl.org/becyt/ford/2The phenomenon of double retrograde vaporization (DRV) has been simulated using the group contribution equation of state coupled with the Michelsen computational procedures for calculating phase envelopes. This behavior was studied for a number of binary mixtures of near critical fluids with a low volatile component. For the binary systems ethane+limonene, ethane+linalool, methane+butane, and methane+pentane the "double-domed" and "S" shaped curves were successfully predicted and found to be in good agreement with the experimental information available. Prediction of DRV in a number of binary systems from different families further confirmed the idea of the generality of this behavior in all asymmetric mixtures. All results indicate that as the solute increases in molecular size, the composition at which the phenomenon of DRV starts to appear shifts to higher solvent concentration, while simultaneously covering a wider composition range. For the homologous n-alkane series in binary mixtures with C1 up to C5 as near-critical solvents, a correlation in the appearance of the phenomenon of DRV with the hard-sphere diameter of the solvent was observed. Although for each solvent, the lower limit of solute carbon number that shows DRV is easily estimated, the upper carbon number could not always be determined because the occurrence of liquid-liquid immiscibility interferes with the DRV phenomenon. In binary mixtures of CO2 with homologous members of alkyl esters, no liquid-liquid immiscibility was predicted, so it was possible to determine both the lower and upper concentration bounds of DRV.Fil: Espinosa, Susana. 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: Raeissi, S.. Delft University of Technology; Países BajosFil: Brignole, Esteban Alberto. 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: Peters, Cornelis J.. Delft University of Technology; Países BajosElsevier Science2004-12info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionhttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdfapplication/pdfhttp://hdl.handle.net/11336/97829Espinosa, Susana; Raeissi, S.; Brignole, Esteban Alberto; Peters, Cornelis J.; Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series; Elsevier Science; Journal of Supercritical Fluids; 32; 1-3; 12-2004; 63-710896-8446CONICET DigitalCONICETenginfo:eu-repo/semantics/altIdentifier/url/https://www.sciencedirect.com/science/article/pii/S0896844604000221info:eu-repo/semantics/altIdentifier/doi/10.1016/j.supflu.2004.01.008info:eu-repo/semantics/openAccesshttps://creativecommons.org/licenses/by-nc-sa/2.5/ar/reponame:CONICET Digital (CONICET)instname:Consejo Nacional de Investigaciones Científicas y Técnicas2025-09-29T10:09:21Zoai:ri.conicet.gov.ar:11336/97829instacron: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:34982025-09-29 10:09:21.854CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicasfalse |
dc.title.none.fl_str_mv |
Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series |
title |
Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series |
spellingShingle |
Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series Espinosa, Susana ALKANES DILUTE GROUP CONTRIBUTION PHASE BEHAVIOR RETROGRADE CONDENSATION SIMULATION SUPERCRITICAL |
title_short |
Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series |
title_full |
Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series |
title_fullStr |
Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series |
title_full_unstemmed |
Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series |
title_sort |
Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series |
dc.creator.none.fl_str_mv |
Espinosa, Susana Raeissi, S. Brignole, Esteban Alberto Peters, Cornelis J. |
author |
Espinosa, Susana |
author_facet |
Espinosa, Susana Raeissi, S. Brignole, Esteban Alberto Peters, Cornelis J. |
author_role |
author |
author2 |
Raeissi, S. Brignole, Esteban Alberto Peters, Cornelis J. |
author2_role |
author author author |
dc.subject.none.fl_str_mv |
ALKANES DILUTE GROUP CONTRIBUTION PHASE BEHAVIOR RETROGRADE CONDENSATION SIMULATION SUPERCRITICAL |
topic |
ALKANES DILUTE GROUP CONTRIBUTION PHASE BEHAVIOR RETROGRADE CONDENSATION SIMULATION SUPERCRITICAL |
purl_subject.fl_str_mv |
https://purl.org/becyt/ford/2.4 https://purl.org/becyt/ford/2 |
dc.description.none.fl_txt_mv |
The phenomenon of double retrograde vaporization (DRV) has been simulated using the group contribution equation of state coupled with the Michelsen computational procedures for calculating phase envelopes. This behavior was studied for a number of binary mixtures of near critical fluids with a low volatile component. For the binary systems ethane+limonene, ethane+linalool, methane+butane, and methane+pentane the "double-domed" and "S" shaped curves were successfully predicted and found to be in good agreement with the experimental information available. Prediction of DRV in a number of binary systems from different families further confirmed the idea of the generality of this behavior in all asymmetric mixtures. All results indicate that as the solute increases in molecular size, the composition at which the phenomenon of DRV starts to appear shifts to higher solvent concentration, while simultaneously covering a wider composition range. For the homologous n-alkane series in binary mixtures with C1 up to C5 as near-critical solvents, a correlation in the appearance of the phenomenon of DRV with the hard-sphere diameter of the solvent was observed. Although for each solvent, the lower limit of solute carbon number that shows DRV is easily estimated, the upper carbon number could not always be determined because the occurrence of liquid-liquid immiscibility interferes with the DRV phenomenon. In binary mixtures of CO2 with homologous members of alkyl esters, no liquid-liquid immiscibility was predicted, so it was possible to determine both the lower and upper concentration bounds of DRV. Fil: Espinosa, Susana. 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: Raeissi, S.. Delft University of Technology; Países Bajos Fil: Brignole, Esteban Alberto. 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: Peters, Cornelis J.. Delft University of Technology; Países Bajos |
description |
The phenomenon of double retrograde vaporization (DRV) has been simulated using the group contribution equation of state coupled with the Michelsen computational procedures for calculating phase envelopes. This behavior was studied for a number of binary mixtures of near critical fluids with a low volatile component. For the binary systems ethane+limonene, ethane+linalool, methane+butane, and methane+pentane the "double-domed" and "S" shaped curves were successfully predicted and found to be in good agreement with the experimental information available. Prediction of DRV in a number of binary systems from different families further confirmed the idea of the generality of this behavior in all asymmetric mixtures. All results indicate that as the solute increases in molecular size, the composition at which the phenomenon of DRV starts to appear shifts to higher solvent concentration, while simultaneously covering a wider composition range. For the homologous n-alkane series in binary mixtures with C1 up to C5 as near-critical solvents, a correlation in the appearance of the phenomenon of DRV with the hard-sphere diameter of the solvent was observed. Although for each solvent, the lower limit of solute carbon number that shows DRV is easily estimated, the upper carbon number could not always be determined because the occurrence of liquid-liquid immiscibility interferes with the DRV phenomenon. In binary mixtures of CO2 with homologous members of alkyl esters, no liquid-liquid immiscibility was predicted, so it was possible to determine both the lower and upper concentration bounds of DRV. |
publishDate |
2004 |
dc.date.none.fl_str_mv |
2004-12 |
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/11336/97829 Espinosa, Susana; Raeissi, S.; Brignole, Esteban Alberto; Peters, Cornelis J.; Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series; Elsevier Science; Journal of Supercritical Fluids; 32; 1-3; 12-2004; 63-71 0896-8446 CONICET Digital CONICET |
url |
http://hdl.handle.net/11336/97829 |
identifier_str_mv |
Espinosa, Susana; Raeissi, S.; Brignole, Esteban Alberto; Peters, Cornelis J.; Prediction of double retrograde vaporization: Transitions in binary mixtures of near critical fluids with components of homologous series; Elsevier Science; Journal of Supercritical Fluids; 32; 1-3; 12-2004; 63-71 0896-8446 CONICET Digital CONICET |
dc.language.none.fl_str_mv |
eng |
language |
eng |
dc.relation.none.fl_str_mv |
info:eu-repo/semantics/altIdentifier/url/https://www.sciencedirect.com/science/article/pii/S0896844604000221 info:eu-repo/semantics/altIdentifier/doi/10.1016/j.supflu.2004.01.008 |
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 |
Elsevier Science |
publisher.none.fl_str_mv |
Elsevier Science |
dc.source.none.fl_str_mv |
reponame:CONICET Digital (CONICET) instname:Consejo Nacional de Investigaciones Científicas y Técnicas |
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CONICET Digital (CONICET) |
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CONICET Digital (CONICET) |
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Consejo Nacional de Investigaciones Científicas y Técnicas |
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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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1844613971031621632 |
score |
13.070432 |