Corrosion inhibition behavior of two quinoline chalcones: insights from density functional theory

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dc.authorid0000-0001-9310-5407en_US
dc.contributor.authorGece, Ender Gökhan
dc.date.accessioned2021-03-20T20:15:06Z
dc.date.available2021-03-20T20:15:06Z
dc.date.issued2015
dc.departmentBTÜ, Mühendislik ve Doğa Bilimleri Fakültesi, Kimya Bölümüen_US
dc.description.abstractThere has been a considerable surge of experimental inquiry in recent years into understanding the factors responsible for the corrosion inhibition efficiency of chalcones; however, the question of what actually determines the efficiency still remains a topic of debate. In this study, the dependence of the inhibition effect of such two compounds, namely, 3-(3-oxo-3-phenyl-propenyl)-1H-quinolin-2-one and 3-(3-oxo-3-phenyl-propenyl)-1H-benzoquinolin-2-one, on their molecular and electronic structure is analyzed using density functional theory calculations. In agreement with experiments, this study found strong evidence to link corrosion inhibition property of the compounds to their actual molecular structures in acidic media.en_US
dc.identifier.doi10.1515/corrrev-2015-0028en_US
dc.identifier.endpage202en_US
dc.identifier.issn0334-6005
dc.identifier.issn2191-0316
dc.identifier.issue3-4en_US
dc.identifier.scopusqualityQ2en_US
dc.identifier.startpage195en_US
dc.identifier.urihttp://doi.org/10.1515/corrrev-2015-0028
dc.identifier.urihttps://hdl.handle.net/20.500.12885/1151
dc.identifier.volume33en_US
dc.identifier.wosWOS:000358316300007en_US
dc.identifier.wosqualityQ2en_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.indekslendigikaynakScopusen_US
dc.institutionauthorGece, Ender Gökhan
dc.language.isoenen_US
dc.publisherWalter De Gruyter Gmbhen_US
dc.relation.ispartofCorrosion Reviewsen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectcarbon steelen_US
dc.subjectchalconesen_US
dc.subjectcorrosionen_US
dc.subjectDFTen_US
dc.subjectinhibitorsen_US
dc.titleCorrosion inhibition behavior of two quinoline chalcones: insights from density functional theoryen_US
dc.typeArticleen_US

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