Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated Dispersion

Detalhes bibliográficos
Autor(a) principal: Ribeiro, Margarida M.
Data de Publicação: 2011
Outros Autores: Regueiras, Pedro F., Guimarães, Margarida M. L., Madureira, Carlos M. N., Cruz Pinto, José J. C.
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos)
Texto Completo: http://hdl.handle.net/10400.22/10238
Resumo: The highly dynamic behavior of liquid-liquid dispersions in reaction and separation operations still defies accurate and experimentally validated modeling. This behavior is characterized by simultaneous dropsize and operating conditions dependent drop breakage and coalescence, which strongly influence both the hydrodynamics and the reaction yield and selectivity, or separation performance, of such systems. This dynamic character of the behavior is present and of critical importance even at steady state, and not just during the transient evolution toward it or during disturbances in the operating conditions. This work addresses the measurement (by a noninvasive technique) and the optimization of kinetic liquid drop interaction parameters, duly taking into account the full and real complexity of the behavior, which is shown to require the inclusion and quantification of drop coalescence frequencies, no matter how lean and strongly agitated the dispersion may be. The analysis in this paper is limited to batch perfectly agitated vessels with lean dispersions at steady state and uses carefully collected experimental drop size distribution data and a very precise (with 50 logarithmic drop volume classes, to ensure uniform precision of drop size assignment) and fast coupled numerical dynamic simulation and nonlinear optimization algorithm, to quantify the drop breakage and coalescence kinetic parameters of drop interaction models. Significant physical insight has been gained on the interdependence of two (one for breakage and the other for coalescence) of the parameters and on the values of the others, in addition to an excellent agreement of the predicted and experimental drop size distributions at steady state. Further, and as expected, the need to always fully account for interdrop coalescence (in addition to breakage), whatever the operating conditions, by contrast to oversimplified modeling approaches, has also been clearly demonstrated.
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spelling Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated DispersionThe highly dynamic behavior of liquid-liquid dispersions in reaction and separation operations still defies accurate and experimentally validated modeling. This behavior is characterized by simultaneous dropsize and operating conditions dependent drop breakage and coalescence, which strongly influence both the hydrodynamics and the reaction yield and selectivity, or separation performance, of such systems. This dynamic character of the behavior is present and of critical importance even at steady state, and not just during the transient evolution toward it or during disturbances in the operating conditions. This work addresses the measurement (by a noninvasive technique) and the optimization of kinetic liquid drop interaction parameters, duly taking into account the full and real complexity of the behavior, which is shown to require the inclusion and quantification of drop coalescence frequencies, no matter how lean and strongly agitated the dispersion may be. The analysis in this paper is limited to batch perfectly agitated vessels with lean dispersions at steady state and uses carefully collected experimental drop size distribution data and a very precise (with 50 logarithmic drop volume classes, to ensure uniform precision of drop size assignment) and fast coupled numerical dynamic simulation and nonlinear optimization algorithm, to quantify the drop breakage and coalescence kinetic parameters of drop interaction models. Significant physical insight has been gained on the interdependence of two (one for breakage and the other for coalescence) of the parameters and on the values of the others, in addition to an excellent agreement of the predicted and experimental drop size distributions at steady state. Further, and as expected, the need to always fully account for interdrop coalescence (in addition to breakage), whatever the operating conditions, by contrast to oversimplified modeling approaches, has also been clearly demonstrated.American Chemical SocietyRepositório Científico do Instituto Politécnico do PortoRibeiro, Margarida M.Regueiras, Pedro F.Guimarães, Margarida M. L.Madureira, Carlos M. N.Cruz Pinto, José J. C.20112117-01-01T00:00:00Z2011-01-01T00:00:00Zinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articleapplication/pdfhttp://hdl.handle.net/10400.22/10238eng10.1021/ie100368tmetadata only accessinfo:eu-repo/semantics/openAccessreponame:Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos)instname:Agência para a Sociedade do Conhecimento (UMIC) - FCT - Sociedade da Informaçãoinstacron:RCAAP2023-03-13T12:51:44Zoai:recipp.ipp.pt:10400.22/10238Portal AgregadorONGhttps://www.rcaap.pt/oai/openaireopendoar:71602024-03-19T17:30:40.017660Repositório Científico de Acesso Aberto de Portugal (Repositórios Cientìficos) - Agência para a Sociedade do Conhecimento (UMIC) - FCT - Sociedade da Informaçãofalse
dc.title.none.fl_str_mv Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated Dispersion
title Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated Dispersion
spellingShingle Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated Dispersion
Ribeiro, Margarida M.
title_short Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated Dispersion
title_full Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated Dispersion
title_fullStr Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated Dispersion
title_full_unstemmed Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated Dispersion
title_sort Optimization of Breakage and Coalescence Model Parameters in a Steady-State Batch Agitated Dispersion
author Ribeiro, Margarida M.
author_facet Ribeiro, Margarida M.
Regueiras, Pedro F.
Guimarães, Margarida M. L.
Madureira, Carlos M. N.
Cruz Pinto, José J. C.
author_role author
author2 Regueiras, Pedro F.
Guimarães, Margarida M. L.
Madureira, Carlos M. N.
Cruz Pinto, José J. C.
author2_role author
author
author
author
dc.contributor.none.fl_str_mv Repositório Científico do Instituto Politécnico do Porto
dc.contributor.author.fl_str_mv Ribeiro, Margarida M.
Regueiras, Pedro F.
Guimarães, Margarida M. L.
Madureira, Carlos M. N.
Cruz Pinto, José J. C.
description The highly dynamic behavior of liquid-liquid dispersions in reaction and separation operations still defies accurate and experimentally validated modeling. This behavior is characterized by simultaneous dropsize and operating conditions dependent drop breakage and coalescence, which strongly influence both the hydrodynamics and the reaction yield and selectivity, or separation performance, of such systems. This dynamic character of the behavior is present and of critical importance even at steady state, and not just during the transient evolution toward it or during disturbances in the operating conditions. This work addresses the measurement (by a noninvasive technique) and the optimization of kinetic liquid drop interaction parameters, duly taking into account the full and real complexity of the behavior, which is shown to require the inclusion and quantification of drop coalescence frequencies, no matter how lean and strongly agitated the dispersion may be. The analysis in this paper is limited to batch perfectly agitated vessels with lean dispersions at steady state and uses carefully collected experimental drop size distribution data and a very precise (with 50 logarithmic drop volume classes, to ensure uniform precision of drop size assignment) and fast coupled numerical dynamic simulation and nonlinear optimization algorithm, to quantify the drop breakage and coalescence kinetic parameters of drop interaction models. Significant physical insight has been gained on the interdependence of two (one for breakage and the other for coalescence) of the parameters and on the values of the others, in addition to an excellent agreement of the predicted and experimental drop size distributions at steady state. Further, and as expected, the need to always fully account for interdrop coalescence (in addition to breakage), whatever the operating conditions, by contrast to oversimplified modeling approaches, has also been clearly demonstrated.
publishDate 2011
dc.date.none.fl_str_mv 2011
2011-01-01T00:00:00Z
2117-01-01T00:00:00Z
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dc.publisher.none.fl_str_mv American Chemical Society
publisher.none.fl_str_mv American Chemical Society
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