Development and application of a three-parameter RK-PR equation of state

Autores
Cismondi Duarte, Martín; Mollerup, Jørgen
Año de publicación
2005
Idioma
inglés
Tipo de recurso
artículo
Estado
versión publicada
Descripción
In this work, we confirm the somehow previously expressed but not widespread idea that the limitations of cubic equations of state like Soave-Redlich-Kwong equation (SRK) or Peng-Robinson equation (PR) are a consequence of their two-parameter density dependence rather than of their empiric character. Moreover, it is shown that when combined with a simple generalized van der Waals attraction term, the van der Waals repulsion is more capable than the Carnahan-Starling term to follow the PvT behaviour of real fluids and, in particular, that the generalized Redlich-Kwong-Peng-Robinson (RK-PR) equation offers the best performance among cubic three-parameter density functionalities. A simple temperature dependence was developed and a straightforward parameterization procedure established. This simple - and optimized from pure compound data - three-parameter equation of state (3P-EoS) will allow in a later stage, by systematic study and comparison to other types of 3P-EoS, to find out what the actual possibilities and limitations of cubic EoS are in the modelling of phase equilibria for asymmetric systems.
Fil: Cismondi Duarte, Martín. Technical University of Denmark; Dinamarca. 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: Mollerup, Jørgen. Technical University of Denmark; Dinamarca
Materia
ALKANES
CARBON DIOXIDE
CRITICAL POINT
DENSITY
EQUATION OF STATE
PATEL-TEJA EOS
PR
SRK
THIRD PARAMETER
VAPOUR PRESSURE
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:11336/97032
Acceder
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oai_identifier_str oai:ri.conicet.gov.ar:11336/97032
network_acronym_str CONICETDig
repository_id_str 3498
network_name_str CONICET Digital (CONICET)
spelling Development and application of a three-parameter RK-PR equation of stateCismondi Duarte, MartínMollerup, JørgenALKANESCARBON DIOXIDECRITICAL POINTDENSITYEQUATION OF STATEPATEL-TEJA EOSPRSRKTHIRD PARAMETERVAPOUR PRESSUREhttps://purl.org/becyt/ford/2.4https://purl.org/becyt/ford/2In this work, we confirm the somehow previously expressed but not widespread idea that the limitations of cubic equations of state like Soave-Redlich-Kwong equation (SRK) or Peng-Robinson equation (PR) are a consequence of their two-parameter density dependence rather than of their empiric character. Moreover, it is shown that when combined with a simple generalized van der Waals attraction term, the van der Waals repulsion is more capable than the Carnahan-Starling term to follow the PvT behaviour of real fluids and, in particular, that the generalized Redlich-Kwong-Peng-Robinson (RK-PR) equation offers the best performance among cubic three-parameter density functionalities. A simple temperature dependence was developed and a straightforward parameterization procedure established. This simple - and optimized from pure compound data - three-parameter equation of state (3P-EoS) will allow in a later stage, by systematic study and comparison to other types of 3P-EoS, to find out what the actual possibilities and limitations of cubic EoS are in the modelling of phase equilibria for asymmetric systems.Fil: Cismondi Duarte, Martín. Technical University of Denmark; Dinamarca. 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: Mollerup, Jørgen. Technical University of Denmark; DinamarcaElsevier Science2005-05info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionhttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdfapplication/pdfhttp://hdl.handle.net/11336/97032Cismondi Duarte, Martín; Mollerup, Jørgen; Development and application of a three-parameter RK-PR equation of state; Elsevier Science; Fluid Phase Equilibria; 232; 1-2; 5-2005; 74-890378-3812CONICET DigitalCONICETenginfo:eu-repo/semantics/altIdentifier/doi/10.1016/j.fluid.2005.03.020info:eu-repo/semantics/altIdentifier/url/https://www.sciencedirect.com/science/article/pii/S0378381205000828info:eu-repo/semantics/openAccesshttps://creativecommons.org/licenses/by-nc-sa/2.5/ar/reponame:CONICET Digital (CONICET)instname:Consejo Nacional de Investigaciones Científicas y Técnicas2025-09-29T09:51:38Zoai:ri.conicet.gov.ar:11336/97032instacron: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 09:51:38.299CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicasfalse
dc.title.none.fl_str_mv Development and application of a three-parameter RK-PR equation of state
title Development and application of a three-parameter RK-PR equation of state
spellingShingle Development and application of a three-parameter RK-PR equation of state
Cismondi Duarte, Martín
ALKANES
CARBON DIOXIDE
CRITICAL POINT
DENSITY
EQUATION OF STATE
PATEL-TEJA EOS
PR
SRK
THIRD PARAMETER
VAPOUR PRESSURE
title_short Development and application of a three-parameter RK-PR equation of state
title_full Development and application of a three-parameter RK-PR equation of state
title_fullStr Development and application of a three-parameter RK-PR equation of state
title_full_unstemmed Development and application of a three-parameter RK-PR equation of state
title_sort Development and application of a three-parameter RK-PR equation of state
dc.creator.none.fl_str_mv Cismondi Duarte, Martín
Mollerup, Jørgen
author Cismondi Duarte, Martín
author_facet Cismondi Duarte, Martín
Mollerup, Jørgen
author_role author
author2 Mollerup, Jørgen
author2_role author
dc.subject.none.fl_str_mv ALKANES
CARBON DIOXIDE
CRITICAL POINT
DENSITY
EQUATION OF STATE
PATEL-TEJA EOS
PR
SRK
THIRD PARAMETER
VAPOUR PRESSURE
topic ALKANES
CARBON DIOXIDE
CRITICAL POINT
DENSITY
EQUATION OF STATE
PATEL-TEJA EOS
PR
SRK
THIRD PARAMETER
VAPOUR PRESSURE
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 confirm the somehow previously expressed but not widespread idea that the limitations of cubic equations of state like Soave-Redlich-Kwong equation (SRK) or Peng-Robinson equation (PR) are a consequence of their two-parameter density dependence rather than of their empiric character. Moreover, it is shown that when combined with a simple generalized van der Waals attraction term, the van der Waals repulsion is more capable than the Carnahan-Starling term to follow the PvT behaviour of real fluids and, in particular, that the generalized Redlich-Kwong-Peng-Robinson (RK-PR) equation offers the best performance among cubic three-parameter density functionalities. A simple temperature dependence was developed and a straightforward parameterization procedure established. This simple - and optimized from pure compound data - three-parameter equation of state (3P-EoS) will allow in a later stage, by systematic study and comparison to other types of 3P-EoS, to find out what the actual possibilities and limitations of cubic EoS are in the modelling of phase equilibria for asymmetric systems.
Fil: Cismondi Duarte, Martín. Technical University of Denmark; Dinamarca. 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: Mollerup, Jørgen. Technical University of Denmark; Dinamarca
description In this work, we confirm the somehow previously expressed but not widespread idea that the limitations of cubic equations of state like Soave-Redlich-Kwong equation (SRK) or Peng-Robinson equation (PR) are a consequence of their two-parameter density dependence rather than of their empiric character. Moreover, it is shown that when combined with a simple generalized van der Waals attraction term, the van der Waals repulsion is more capable than the Carnahan-Starling term to follow the PvT behaviour of real fluids and, in particular, that the generalized Redlich-Kwong-Peng-Robinson (RK-PR) equation offers the best performance among cubic three-parameter density functionalities. A simple temperature dependence was developed and a straightforward parameterization procedure established. This simple - and optimized from pure compound data - three-parameter equation of state (3P-EoS) will allow in a later stage, by systematic study and comparison to other types of 3P-EoS, to find out what the actual possibilities and limitations of cubic EoS are in the modelling of phase equilibria for asymmetric systems.
publishDate 2005
dc.date.none.fl_str_mv 2005-05
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/11336/97032
Cismondi Duarte, Martín; Mollerup, Jørgen; Development and application of a three-parameter RK-PR equation of state; Elsevier Science; Fluid Phase Equilibria; 232; 1-2; 5-2005; 74-89
0378-3812
CONICET Digital
CONICET
url http://hdl.handle.net/11336/97032
identifier_str_mv Cismondi Duarte, Martín; Mollerup, Jørgen; Development and application of a three-parameter RK-PR equation of state; Elsevier Science; Fluid Phase Equilibria; 232; 1-2; 5-2005; 74-89
0378-3812
CONICET Digital
CONICET
dc.language.none.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv info:eu-repo/semantics/altIdentifier/doi/10.1016/j.fluid.2005.03.020
info:eu-repo/semantics/altIdentifier/url/https://www.sciencedirect.com/science/article/pii/S0378381205000828
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
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 13.070432

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