A comparative study on electronic and structural properties of transition metal monosilicides, CrSi(B20-type), RhSi(B20-type), RhSi(B31-type) and RhSi(B2-type)

dc.authorid0000-0002-6633-8480
dc.contributor.authorAltıntaş, Bahadır
dc.date.accessioned2021-06-23T19:27:37Z
dc.date.available2021-06-23T19:27:37Z
dc.date.issued2011
dc.departmentBAİBÜ, Eğitim Fakültesi, Bilgisayar ve Öğretim Teknolojileri Eğitimi Bölümüen_US
dc.description.abstractTransition metal based monosilicide compounds (CrSi and RhSi) have been investigated theoretically from ab initio calculations. The structural and electronic band calculations of CrSi and different phases of RhSi crystals show that the metallic property and hypothetically constructed structures of RhSi(Pnma) under different pressures from 0 GPa to 75 GPa show a certain difference only along Gamma-Z directions of the high symmetry points of first Brillouin zone. The character of the bands around fermi level was determined by partial density of state calculations. (C) 2011 Elsevier Ltd. All rights reserved.en_US
dc.identifier.doi10.1016/j.jpcs.2011.07.027
dc.identifier.endpage1329en_US
dc.identifier.issn0022-3697
dc.identifier.issue11en_US
dc.identifier.scopus2-s2.0-80052822111en_US
dc.identifier.scopusqualityQ2en_US
dc.identifier.startpage1325en_US
dc.identifier.urihttps://doi.org/10.1016/j.jpcs.2011.07.027
dc.identifier.urihttps://hdl.handle.net/20.500.12491/6855
dc.identifier.volume72en_US
dc.identifier.wosWOS:000295756000022en_US
dc.identifier.wosqualityQ2en_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.indekslendigikaynakScopusen_US
dc.institutionauthorAltıntaş, Bahadır
dc.language.isoenen_US
dc.publisherPergamon-Elsevier Science Ltden_US
dc.relation.ispartofJournal Of Physics And Chemistry Of Solidsen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectIntermetallic Compoundsen_US
dc.subjectMetalsen_US
dc.subjectAb Initio Calculationsen_US
dc.subjectCrystal Structureen_US
dc.subjectElectronic Structureen_US
dc.titleA comparative study on electronic and structural properties of transition metal monosilicides, CrSi(B20-type), RhSi(B20-type), RhSi(B31-type) and RhSi(B2-type)en_US
dc.typeArticleen_US

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