Please use this identifier to cite or link to this item: https://hdl.handle.net/11147/6679
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dc.contributor.authorKandemir, Ali-
dc.contributor.authorİyikanat, Fadıl-
dc.contributor.authorBacaksız, Cihan-
dc.contributor.authorŞahin, Hasan-
dc.date.accessioned2018-01-12T10:48:21Z
dc.date.available2018-01-12T10:48:21Z
dc.date.issued2017
dc.identifier.citationKandemir, A., İyikanat, F., Bacaksız, C., and Şahin, H. (2017). α-Silicene as oxidation-resistant ultra-thin coating material. Beilstein Journal of Nanotechnology, 8(1). doi:10.3762/bjnano.8.182en_US
dc.identifier.issn2190-4286
dc.identifier.issn2190-4286-
dc.identifier.urihttp://doi.org/10.3762/bjnano.8.182
dc.identifier.urihttp://hdl.handle.net/11147/6679
dc.description.abstractBy performing density functional theory (DFT)-based calculations, the performance of a-silicene as oxidation-resistant coating on Ag(111) surface is investigated. First of all, it is shown that the Ag(111) surface is quite reactive against O atoms and O2 molecules. It is known that when single-layer silicene is formed on the Ag(111) surface, the 3 × 3-reconstructed phase, a-silicene, is the ground state. Our investigation reveals that as a coating layer, a-silicene (i) strongly absorbs single O atoms and (ii) absorbs O2 molecules by breaking the strong O-O bond. (iii) Even the hollow sites, which are found to be most favorable penetration path for oxygens, serves as high-energy oxidation barrier, and (iv) α-silicene becomes more protective and less permeable in the presence of absorbed O atom. It appears that single-layer silicene is a quite promising material for ultra-thin oxidation-protective coating applications.en_US
dc.description.sponsorshipTUBITAK (116C073); The Science Academy, Turkeyen_US
dc.language.isoenen_US
dc.publisherBeilstein-Institut Zur Forderung der Chemischen Wissenschaftenen_US
dc.relationinfo:eu-repo/grantAgreement/TUBITAK/BIDEB/116C073en_US
dc.relation.ispartofBeilstein Journal of Nanotechnologyen_US
dc.rightsinfo:eu-repo/semantics/openAccessen_US
dc.subjectCoating materialen_US
dc.subjectDensity functional theoryen_US
dc.subjectOxidizationen_US
dc.subjectSiliceneen_US
dc.subjectSilveren_US
dc.title?-Silicene as oxidation-resistant ultra-thin coating materialen_US
dc.typeArticleen_US
dc.authoridTR226858en_US
dc.authoridTR202801en_US
dc.authoridTR216960en_US
dc.institutionauthorKandemir, Ali-
dc.institutionauthorİyikanat, Fadıl-
dc.institutionauthorBacaksız, Cihan-
dc.institutionauthorŞahin, Hasan-
dc.departmentIzmir Institute of Technology. Photonics
dc.departmentIzmir Institute of Technology. Physics
dc.departmentIzmir Institute of Technology. Photonicsen_US
dc.departmentIzmir Institute of Technology. Physicsen_US
dc.departmentIzmir Institute of Technology. Materials Science and Engineeringen_US
dc.identifier.volume8en_US
dc.identifier.issue1en_US
dc.identifier.wosWOS:000408666300001
dc.identifier.scopusSCOPUS:2-s2.0-85029003771
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.identifier.doi10.3762/bjnano.8.182-
dc.relation.doi10.3762/bjnano.8.182en_US
dc.coverage.doi10.3762/bjnano.8.182en_US
item.cerifentitytypePublications-
item.openairecristypehttp://purl.org/coar/resource_type/c_18cf-
item.openairetypeArticle-
item.grantfulltextopen-
item.languageiso639-1en-
item.fulltextWith Fulltext-
crisitem.author.deptDepartment of Photonics-
Appears in Collections:Materials Science and Engineering / Malzeme Bilimi ve Mühendisliği
Photonics / Fotonik
Physics / Fizik
PubMed İndeksli Yayınlar Koleksiyonu / PubMed Indexed Publications Collection
Scopus İndeksli Yayınlar Koleksiyonu / Scopus Indexed Publications Collection
WoS İndeksli Yayınlar Koleksiyonu / WoS Indexed Publications Collection
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