Structural parameters and electronic properties of 2D carbon allotrope: graphene with a kagome lattice structure

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buir.contributor.authorÖzbay, Ekmel
buir.contributor.orcidÖzbay, Ekmel|0000-0003-2953-1828
dc.citation.epage138006-1en_US
dc.citation.spage138006-4en_US
dc.citation.volumeNumber760en_US
dc.contributor.authorSarıkavak-Lisesivdin, B.
dc.contributor.authorLisesivdin, S. B.
dc.contributor.authorÖzbay, Ekmel
dc.contributor.authorJelezko, F.
dc.date.accessioned2021-02-20T14:03:29Z
dc.date.available2021-02-20T14:03:29Z
dc.date.issued2020en_US
dc.departmentDepartment of Electrical and Electronics Engineeringen_US
dc.departmentDepartment of Physicsen_US
dc.departmentInstitute of Materials Science and Nanotechnology (UNAM)en_US
dc.departmentNanotechnology Research Center (NANOTAM)en_US
dc.description.abstractIn this paper, the electronic properties of a carbon allotrope, graphene with a kagome lattice structure, are investigated. Spin-polarized density functional theory (DFT) calculations with Grimme dispersion corrections were done. Bond lengths, electronic band structure, and projected density of states were calculated. Electronic band structure calculations show kagome flat-band formation with higher d-orbital contributed bonding behavior than the pristine graphene structure. The structural parameters and electronic band results of this 2D carbon allotrope show wider possible usage in many applications from desalination membranes to possible high- temperature superconductor.en_US
dc.description.provenanceSubmitted by Evrim Ergin (eergin@bilkent.edu.tr) on 2021-02-20T14:03:29Z No. of bitstreams: 1 Structural_parameters_and_electronic_properties_of_2D_carbon_allotrope_Graphene_with_a_kagome_lattice_structure.pdf: 568869 bytes, checksum: 3b7859a602a7238726102da57ff99a0f (MD5)en
dc.description.provenanceMade available in DSpace on 2021-02-20T14:03:29Z (GMT). No. of bitstreams: 1 Structural_parameters_and_electronic_properties_of_2D_carbon_allotrope_Graphene_with_a_kagome_lattice_structure.pdf: 568869 bytes, checksum: 3b7859a602a7238726102da57ff99a0f (MD5) Previous issue date: 2020-09-14en
dc.embargo.release2022-09-14
dc.identifier.doi10.1016/j.cplett.2020.138006en_US
dc.identifier.issn0009-2614
dc.identifier.urihttp://hdl.handle.net/11693/75506
dc.language.isoEnglishen_US
dc.publisherElsevieren_US
dc.relation.isversionofhttps://doi.org/10.1016/j.cplett.2020.138006en_US
dc.source.titleChemical Physics Lettersen_US
dc.subjectTwo-dimensional materialen_US
dc.subjectCarbon allotropeen_US
dc.subjectDensity functional theoryen_US
dc.subjectKagome latticeen_US
dc.titleStructural parameters and electronic properties of 2D carbon allotrope: graphene with a kagome lattice structureen_US
dc.typeArticleen_US

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