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dc.contributor.authorDurandurdu, Murat
dc.date.accessioned2021-09-29T08:48:37Z
dc.date.available2021-09-29T08:48:37Z
dc.date.issued2016en_US
dc.identifier.issn1478-6435
dc.identifier.issn1478-6443
dc.identifier.urihttps://doi.org/10.1080/14786435.2016.1155783
dc.identifier.urihttps://hdl.handle.net/20.500.12573/974
dc.descriptionThis work was supported by the Scientific and Technical Research Council of Turkey (TUBITAK) under [grant number 114C100].en_US
dc.description.abstractWe report the electronic structure and topology of a heavily Si-doped amorphous aluminium nitride (Al37.5Si12.5N50) using ab initio simulations. The amorphous Al37.5Si12.5N50 system is found to be structurally similar to pure amorphous aluminium nitride. It has an average coordination number of about 3.9 and exhibits a small amount of Si-Si homopolar bonds. The formation of Si-Al bonds is not very favourable. Electronic structure calculations reveal that the Si doping has a negligible effect on the band gap width but causes delocalization of the valence band tail states and a shift of the Fermi level towards the conduction band. Thus, amorphous Al37.5Si12.5N50 alloys show n-type conductivity.en_US
dc.description.sponsorshipTurkiye Bilimsel ve Teknolojik Arastirma Kurumu (TUBITAK) 114C100en_US
dc.language.isoengen_US
dc.publisherTAYLOR & FRANCIS LTD2-4 PARK SQUARE, MILTON PARK, ABINGDON OR14 4RN, OXON, ENGLANDen_US
dc.relation.isversionof10.1080/14786435.2016.1155783en_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectmolecular dynamic simulationsen_US
dc.subjectAb initio methoden_US
dc.subjectelectrical conductivityen_US
dc.subjectaluminium alloysen_US
dc.subjectamorphous semiconductorsen_US
dc.subjectdensity-functional methoden_US
dc.titlen-type conductivity in Si-doped amorphous AlN: an ab initio investigationen_US
dc.typearticleen_US
dc.contributor.departmentAGÜ, Mühendislik Fakültesi, Malzeme Bilimi ve Nanoteknoloji Mühendisliği Bölümüen_US
dc.contributor.authorID0000-0001-5636-3183en_US
dc.contributor.institutionauthorDurandurdu, Murat
dc.identifier.volumeVolume 96 Issue 11 Page 1110-1121en_US
dc.relation.journalPHILOSOPHICAL MAGAZINEen_US
dc.relation.tubitak114C100
dc.relation.publicationcategoryMakale - Uluslararası - Editör Denetimli Dergien_US


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