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Molecular modeling of mof-based mixed matrix membranes

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dc.contributor.departmentDepartment of Chemical and Biological Engineering
dc.contributor.departmentGraduate School of Sciences and Engineering
dc.contributor.kuauthorEruçar, İlknur
dc.contributor.kuauthorKeskin, Seda
dc.contributor.schoolcollegeinstituteCollege of Engineering
dc.contributor.schoolcollegeinstituteGRADUATE SCHOOL OF SCIENCES AND ENGINEERING
dc.date.accessioned2024-11-09T23:49:01Z
dc.date.issued2014
dc.description.abstractMetal organic framework (MOF)-based mixed matrix membranes (MMMs) have received significant attention in the last couple of years due to their high gas permeabilities and high gas selectivities compared to pure polymeric membranes in various gas separation applications. Computational methods that can predict the gas separation performances of MOF-based MMMs are highly valuable since experimental screening of these MMMs is not practical given the very large number of combination of MOFs and polymers. In this review, molecular modeling methods and theoretical permeation models that have been used to assess the gas separation performance of MOF-based MMMs are discussed; opportunities and challenges in modeling of MOF/polymer membranes are addressed.
dc.description.indexedbyWOS
dc.description.indexedbyScopus
dc.description.issue18
dc.description.openaccessNO
dc.description.publisherscopeInternational
dc.description.sponsoredbyTubitakEuEU
dc.description.sponsorshipEuropean Commission [FP7-PEOPLE-2010-RG]
dc.description.sponsorshipTUBA-GEBIP Programme S.K. acknowledges support provided by European Commission Marie Curie International Re-integration Grant FP7-PEOPLE-2010-RG and TUBA-GEBIP Programme.
dc.description.volume18
dc.identifier.doi10.2174/1385272819666140806201636
dc.identifier.eissn1875-5348
dc.identifier.issn1385-2728
dc.identifier.scopus2-s2.0-84925861700
dc.identifier.urihttps://doi.org/10.2174/1385272819666140806201636
dc.identifier.urihttps://hdl.handle.net/20.500.14288/14287
dc.identifier.wos344608100006
dc.keywordsGas separation
dc.keywordsmixed matrix membrane
dc.keywordsmetal organic framework
dc.keywordsmolecular modeling
dc.keywordspermeability
dc.keywordsselectivity
dc.keywordstheoretical models
dc.keywordsMetal-organic framework
dc.keywordsEthylene/ethane separation-part
dc.keywordsGas-separation
dc.keywordsThermal-conductivity
dc.keywordsNanocomposite membranes
dc.keywordsComposite membranes
dc.keywordsPolymeric membranes
dc.keywordsPredictive models
dc.keywordsZeolite membranes
dc.keywordsPermeability
dc.language.isoeng
dc.publisherBentham Science Publ Ltd
dc.relation.ispartofCurrent Organic Chemistry
dc.subjectChemistry
dc.subjectOrganic
dc.titleMolecular modeling of mof-based mixed matrix membranes
dc.typeJournal Article
dspace.entity.typePublication
local.contributor.kuauthorEruçar, İlknur
local.contributor.kuauthorKeskin, Seda
local.publication.orgunit1GRADUATE SCHOOL OF SCIENCES AND ENGINEERING
local.publication.orgunit1College of Engineering
local.publication.orgunit2Department of Chemical and Biological Engineering
local.publication.orgunit2Graduate School of Sciences and Engineering
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