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Molecular modelling framework of metal-organic clusters for conserving surfaces: Langmuir sorption through the TD-DFT/ONIOM approach

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dc.contributor.authorMollaamin, Fatemeh
dc.contributor.authorMonajjemi, Majid
dc.date.accessioned2026-01-04T17:38:47Z
dc.date.issued2022-12-28
dc.description.urihttps://doi.org/10.1080/08927022.2022.2159996
dc.identifier.doi10.1080/08927022.2022.2159996
dc.identifier.eissn1029-0435
dc.identifier.endpage376
dc.identifier.issn0892-7022
dc.identifier.openairedoi_________::43148c5494fb55ea325e0fa996714fc6
dc.identifier.scopus2-s2.0-85145380144
dc.identifier.startpage365
dc.identifier.urihttps://hdl.handle.net/20.500.12597/40262
dc.identifier.volume49
dc.identifier.wos000905410900001
dc.language.isoeng
dc.publisherInforma UK Limited
dc.relation.ispartofMolecular Simulation
dc.titleMolecular modelling framework of metal-organic clusters for conserving surfaces: Langmuir sorption through the TD-DFT/ONIOM approach
dc.typeArticle
dspace.entity.typePublication
local.import.sourceOpenAire
local.indexed.atWOS
local.indexed.atScopus

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