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Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation

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Resumo:This work provides an integrated techno-economic and energy assessment of vacuum pressure swing adsorption (VPSA) for postcombustion CO2 capture, bridging laboratory-scale validation with industrial-scale design. The shaped MOF MIL-160(Al) was evaluated through 19 dynamic PSA experiments, which clarified the distinct roles of purge and rinse steps in determining the separation efficiency. The validated process model reliably captured cyclic steady-state dynamics and was extended to simulate 31 industrial VPSA configurations. The results demonstrated that as purge flow increased from 500 to 7.5 & times; 103 L/min, CO2 purity reduced from 91% to 82%, but CO2 recovery increased from 65% to 96%, which corresponds to an enhancement in energy consumption from 1589.2 to 1655 kWh. On the other hand, when rinse flow enhanced from 30 & times; 103 to 39 & times; 103 L/min, CO2 purity increased from 82% to 89%, while CO2 recovery reduced from 90% to 86% and energy consumption increased from 1573.5 to 1657.9 kWh. Techno-economic analysis estimated a total capital investment of $18.89 M and an annualized capital expenditure (CapEx) of $1.82 M & centerdot;yr-1, with operating costs dominated by electricity consumption and, to a lesser extent, labor cost. Overall, the findings prove that industrially viable deployment of MIL-160(Al)-based VPSA requires a combined focus on plant equipment lifetime and process-level energy optimization, thereby providing a clear roadmap for translating experimental performance into large-scale CO2 capture.
Autores principais:Karimi, Mohsen
Outros Autores:Shirzad, Mohammad; Siqueira, Rafael M.; Ferreira, Alexandre; Silva, José A.C.; Rodrigues, Alírio
Assunto:Metal-Organic Frameworks Carbon-Dioxide Capture Adsorbents
Ano:2026
País:Portugal
Tipo de documento:artigo
Tipo de acesso:acesso aberto
Instituição associada:Instituto Politécnico de Bragança
Idioma:inglês
Origem:Biblioteca Digital do IPB
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author Karimi, Mohsen
author2 Shirzad, Mohammad
Siqueira, Rafael M.
Ferreira, Alexandre
Silva, José A.C.
Rodrigues, Alírio
author2_role author
author
author
author
author
author_facet Karimi, Mohsen
Shirzad, Mohammad
Siqueira, Rafael M.
Ferreira, Alexandre
Silva, José A.C.
Rodrigues, Alírio
author_role author
contributor_name_str_mv Biblioteca Digital do IPB
country_str PT
creators_json_txt [{\"Person.name\":\"Karimi, Mohsen\"},{\"Person.name\":\"Shirzad, Mohammad\"},{\"Person.name\":\"Siqueira, Rafael M.\"},{\"Person.name\":\"Ferreira, Alexandre\"},{\"Person.name\":\"Silva, José A.C.\",\"Person.identifier.orcid\":\"0000-0003-1778-3833\"},{\"Person.name\":\"Rodrigues, Alírio\"}]
datacite.contributors.contributor.contributorName.fl_str_mv Biblioteca Digital do IPB
datacite.creators.creator.creatorName.fl_str_mv Karimi, Mohsen
Shirzad, Mohammad
Siqueira, Rafael M.
Ferreira, Alexandre
Silva, José A.C.
Rodrigues, Alírio
datacite.date.Accepted.fl_str_mv 2026-01-01T00:00:00Z
datacite.date.available.fl_str_mv 2026-03-18T11:55:02Z
datacite.date.embargoed.fl_str_mv 2026-03-18T11:55:02Z
datacite.rights.fl_str_mv http://purl.org/coar/access_right/c_abf2
datacite.subjects.subject.fl_str_mv Metal-Organic Frameworks
Carbon-Dioxide Capture
Adsorbents
datacite.titles.title.fl_str_mv Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation
dc.contributor.none.fl_str_mv Biblioteca Digital do IPB
dc.creator.none.fl_str_mv Karimi, Mohsen
Shirzad, Mohammad
Siqueira, Rafael M.
Ferreira, Alexandre
Silva, José A.C.
Rodrigues, Alírio
dc.date.Accepted.fl_str_mv 2026-01-01T00:00:00Z
dc.date.available.fl_str_mv 2026-03-18T11:55:02Z
dc.date.embargoed.fl_str_mv 2026-03-18T11:55:02Z
dc.format.none.fl_str_mv application/pdf
dc.identifier.none.fl_str_mv http://hdl.handle.net/10198/36121
dc.language.none.fl_str_mv eng
dc.publisher.none.fl_str_mv American Chemical Society
dc.rights.cclincense.fl_str_mv http://creativecommons.org/licenses/by-nc/4.0/
dc.rights.none.fl_str_mv http://purl.org/coar/access_right/c_abf2
dc.subject.none.fl_str_mv Metal-Organic Frameworks
Carbon-Dioxide Capture
Adsorbents
dc.title.fl_str_mv Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation
dc.type.none.fl_str_mv http://purl.org/coar/resource_type/c_6501
description This work provides an integrated techno-economic and energy assessment of vacuum pressure swing adsorption (VPSA) for postcombustion CO2 capture, bridging laboratory-scale validation with industrial-scale design. The shaped MOF MIL-160(Al) was evaluated through 19 dynamic PSA experiments, which clarified the distinct roles of purge and rinse steps in determining the separation efficiency. The validated process model reliably captured cyclic steady-state dynamics and was extended to simulate 31 industrial VPSA configurations. The results demonstrated that as purge flow increased from 500 to 7.5 & times; 103 L/min, CO2 purity reduced from 91% to 82%, but CO2 recovery increased from 65% to 96%, which corresponds to an enhancement in energy consumption from 1589.2 to 1655 kWh. On the other hand, when rinse flow enhanced from 30 & times; 103 to 39 & times; 103 L/min, CO2 purity increased from 82% to 89%, while CO2 recovery reduced from 90% to 86% and energy consumption increased from 1573.5 to 1657.9 kWh. Techno-economic analysis estimated a total capital investment of $18.89 M and an annualized capital expenditure (CapEx) of $1.82 M & centerdot;yr-1, with operating costs dominated by electricity consumption and, to a lesser extent, labor cost. Overall, the findings prove that industrially viable deployment of MIL-160(Al)-based VPSA requires a combined focus on plant equipment lifetime and process-level energy optimization, thereby providing a clear roadmap for translating experimental performance into large-scale CO2 capture.
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funding.funder.identifier_str_mv http://doi.org/10.13039/501100001871
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funding.funder.name_str_mv Fundação para a Ciência e a Tecnologia
Fundação para a Ciência e a Tecnologia
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LA/P/0007/2020
funding.name_str_mv CIMO
6817 - DCRRNI ID
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LA/P/0007/2020
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oai_identifier_str oai:bibliotecadigital.ipb.pt:10198/36121
organization_str_mv urn:organizationAcronym:ipb
person_str_mv Karimi, Mohsen
Shirzad, Mohammad
Siqueira, Rafael M.
Ferreira, Alexandre
Silva, José A.C.
Silva, José A.C.
https://www.ciencia-id.pt/C11B-F5CF-7C78
C11B-F5CF-7C78
http://orcid.org/0000-0003-1778-3833
0000-0003-1778-3833
Rodrigues, Alírio
publishDate 2026
publisher.none.fl_str_mv American Chemical Society
reponame_str Biblioteca Digital do IPB
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spelling engAmerican Chemical SocietyengThis work provides an integrated techno-economic and energy assessment of vacuum pressure swing adsorption (VPSA) for postcombustion CO2 capture, bridging laboratory-scale validation with industrial-scale design. The shaped MOF MIL-160(Al) was evaluated through 19 dynamic PSA experiments, which clarified the distinct roles of purge and rinse steps in determining the separation efficiency. The validated process model reliably captured cyclic steady-state dynamics and was extended to simulate 31 industrial VPSA configurations. The results demonstrated that as purge flow increased from 500 to 7.5 & times; 103 L/min, CO2 purity reduced from 91% to 82%, but CO2 recovery increased from 65% to 96%, which corresponds to an enhancement in energy consumption from 1589.2 to 1655 kWh. On the other hand, when rinse flow enhanced from 30 & times; 103 to 39 & times; 103 L/min, CO2 purity increased from 82% to 89%, while CO2 recovery reduced from 90% to 86% and energy consumption increased from 1573.5 to 1657.9 kWh. Techno-economic analysis estimated a total capital investment of $18.89 M and an annualized capital expenditure (CapEx) of $1.82 M & centerdot;yr-1, with operating costs dominated by electricity consumption and, to a lesser extent, labor cost. Overall, the findings prove that industrially viable deployment of MIL-160(Al)-based VPSA requires a combined focus on plant equipment lifetime and process-level energy optimization, thereby providing a clear roadmap for translating experimental performance into large-scale CO2 capture.application/pdfengTechno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial ImplementationKarimi, MohsenShirzad, MohammadSiqueira, Rafael M.Ferreira, AlexandrePersonalSilva, José A.C.DSpacehttp://dspace.org/items/16366ede-a7d6-45ff-a8c9-eff9bdde35c7DSpacehttp://dspace.org/items/16366ede-a7d6-45ff-a8c9-eff9bdde35c7SilvaJosé A.C.Ciência IDhttps://www.ciencia-id.ptC11B-F5CF-7C78ORCIDhttp://orcid.org0000-0003-1778-3833Scopus Author IDhttps://www.scopus.com7403023684Rodrigues, AlírioHostingInstitutionOrganizationalBiblioteca Digital do IPBe-mailmailto:dspace@ipb.ptdspace@ipb.ptISSNIsPartOf0888-5885ISSNIsPartOf1520-5045DOIIsPartOf10.1021/acs.iecr.5c049312026-03-18T11:55:02Z20262026-01-01T00:00:00ZHandlehttp://hdl.handle.net/10198/36121http://purl.org/coar/access_right/c_abf2open accessMetal-Organic FrameworksCarbon-Dioxide CaptureAdsorbents11244788 bytesFundação para a Ciência e a TecnologiaMountain Research Center - UID/00690/2025http://hdl.handle.net/10198/35759UID/00690/2025CIMOCrossref Funder IDhttp://doi.org/10.13039/501100001871Fundação para a Ciência e a TecnologiaAssociate Laboratory for Sustainability and Tecnology in Mountain Regions - LA/P/0007/2020info:eu-repo/grantAgreement/FCT/6817 - DCRRNI ID/LA%2FP%2F0007%2F2020/PTLA/P/0007/20206817 - DCRRNI IDCrossref Funder IDhttp://doi.org/10.13039/501100001871literaturehttp://purl.org/coar/resource_type/c_6501journal article2026http://creativecommons.org/licenses/by-nc/4.0/http://purl.org/coar/access_right/c_abf2application/pdffulltexthttps://bibliotecadigital.ipb.pt/bitstreams/d1c3090c-bfdb-426c-92a4-f62f774c9a25/downloadIndustrial & Engineering Chemistry Research65846334647
spellingShingle Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation
Karimi, Mohsen
Metal-Organic Frameworks
Carbon-Dioxide Capture
Adsorbents
status SINGLETON
subject.fl_str_mv Metal-Organic Frameworks
Carbon-Dioxide Capture
Adsorbents
title Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation
title_full Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation
title_fullStr Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation
title_full_unstemmed Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation
title_short Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation
title_sort Techno-Economic and Energy Assessment of the Pressure Swing Adsorption Process for CO2Capture from Flue Gas Using Shaped MOF MIL-160(Al): Bridging Experimental Results into Industrial Implementation
topic Metal-Organic Frameworks
Carbon-Dioxide Capture
Adsorbents
topic_facet Metal-Organic Frameworks
Carbon-Dioxide Capture
Adsorbents
url http://hdl.handle.net/10198/36121
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