First-principles studies on structural and electronic properties of ThN

dc.contributor.authorArslan, S.
dc.contributor.authorÇiftçi, Y.Ö.
dc.contributor.authorÇolakoğlu, Kemal
dc.contributor.authorDeligöz, Engin
dc.date.accessioned2024-10-16T11:55:15Z
dc.date.available2024-10-16T11:55:15Z
dc.date.issued2007
dc.departmentSabire Yazıcı Fen Edebiyat Fakültesi
dc.description.abstractWe present an ab?initio study of the structural and electronic properties of ThN. The plane?wave pseudopotential approach to the density?functional theory within the generalized?gradient approximation implemented in VASP(Viena Ab?initio Simulation Package) is used. The calculated lattice parameter, elastic constants and band structures are compared with the available experimental and the other theoretical results, and good agreement is obtained.
dc.identifier.doi10.1063/1.2733319
dc.identifier.scopusqualityQ4
dc.identifier.urihttps://doi.org/10.1063/1.2733319
dc.identifier.urihttps://hdl.handle.net/20.500.12451/12556
dc.indekslendigikaynakScopus
dc.language.isoen
dc.publisherAIP Publishing
dc.relation.ispartofAIP Conference Proceedings
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı
dc.rightsinfo:eu-repo/semantics/closedAccess
dc.subjectPrinciples Studies
dc.subjectStructural
dc.subjectElectronic
dc.titleFirst-principles studies on structural and electronic properties of ThN
dc.typeArticle

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