Please use this identifier to cite or link to this item: https://hdl.handle.net/20.500.11851/8173
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dc.contributor.authorBafekry, A.-
dc.contributor.authorFaraji, M.-
dc.contributor.authorKarbasizadeh, S.-
dc.contributor.authorSarsari, I. Abdolhosseini-
dc.contributor.authorJappor, H. R.-
dc.contributor.authorGhergherehchi, M.-
dc.contributor.authorGogova, D.-
dc.date.accessioned2022-01-15T12:58:52Z-
dc.date.available2022-01-15T12:58:52Z-
dc.date.issued2021-
dc.identifier.issn1463-9076-
dc.identifier.issn1463-9084-
dc.identifier.urihttps://doi.org/10.1039/d1cp03078g-
dc.identifier.urihttps://hdl.handle.net/20.500.11851/8173-
dc.description.abstractDriven by the fabrication of bulk and monolayer FeTe2 (ACS Nano, 2020, 14, 11473-11481), we explore the lattice, dynamic stability, electronic and magnetic properties of FeTeS and FeSeS Janus monolayers using density functional theory calculations. The obtained results validate the dynamic and thermal stability of the FeTeS and FeSeS Janus monolayers examined. The electronic structure shows that the FeTe2 bulk yields a total magnetization higher than the FeTe2 monolayer. FeTeS and FeSeS are categorized as ferromagnetic metals due to their bands crossing the Fermi level. So, they can be a good candidate material for spin filter applications. The biaxial compressive strain on the FeTe2 monolayer tunes the bandgap of the spin-down channel in the half-metal phase. By contrast, for FeTeS, the biaxial strain transforms the ferromagnetic metal into a half-metal. The electric field applied to the FeSeS monolayer in a parallel direction transforms the half-metal to a ferromagnetic metal by closing the gap in the spin-down channel.en_US
dc.description.sponsorshipNational Research Foundation of Korea (NRF) - Korea government (MSIT) [NRF-2015M2B2A4033123]en_US
dc.description.sponsorshipThis work was supported by the National Research Foundation of Korea (NRF) grant funded by the Korea government (MSIT) (NRF-2015M2B2A4033123).en_US
dc.language.isoenen_US
dc.publisherRoyal Soc Chemistryen_US
dc.relation.ispartofPhysical Chemistry Chemical Physicsen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.titleTwo-dimensional FeTe2 and predicted Janus FeXS (X: Te and Se) monolayers with intrinsic half-metallic character: tunable electronic and magnetic properties via strain and electric fielden_US
dc.typeArticleen_US
dc.departmentFaculties, Faculty of Engineering, Department of Material Science and Nanotechnology Engineeringen_US
dc.departmentFakülteler, Mühendislik Fakültesi, Malzeme Bilimi ve Nanoteknoloji Mühendisliği Bölümütr_TR
dc.identifier.volume23en_US
dc.identifier.issue42en_US
dc.identifier.startpage24336en_US
dc.identifier.endpage24343en_US
dc.authoridJappor, Hamad Rahman / 0000-0002-8885-3985-
dc.identifier.wosWOS:000709883700001en_US
dc.identifier.scopus2-s2.0-85118613110en_US
dc.institutionauthorFaraji, Mehrdad-
dc.identifier.pmid34676853en_US
dc.identifier.doi10.1039/d1cp03078g-
dc.authorwosidJappor, Hamad Rahman / K-6055-2013-
dc.authorscopusid57208817264-
dc.authorscopusid57215436031-
dc.authorscopusid57220891244-
dc.authorscopusid57131011300-
dc.authorscopusid50861445000-
dc.authorscopusid35275008800-
dc.authorscopusid6603921476-
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.identifier.scopusqualityQ2-
item.fulltextNo Fulltext-
item.grantfulltextnone-
item.openairetypeArticle-
item.openairecristypehttp://purl.org/coar/resource_type/c_18cf-
item.languageiso639-1en-
item.cerifentitytypePublications-
Appears in Collections:Malzeme Bilimi ve Nanoteknoloji Mühendisliği Bölümü / Department of Material Science & Nanotechnology Engineering
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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