Lattice dynamical properties of ScB2, TiB2, and VB2 compounds

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dc.authoridColakoglu, Kemal -- 0000-0003-4108-2404;
dc.contributor.authorDeligöz, Engin
dc.contributor.authorÇolako?lu, Kemal
dc.contributor.authorÇiftçi, Yasemin Öztekin
dc.date.accessioned13.07.201910:50:10
dc.date.accessioned2019-07-29T19:26:34Z
dc.date.available13.07.201910:50:10
dc.date.available2019-07-29T19:26:34Z
dc.date.issued2009
dc.departmentFen-Edebiyat Fakültesi
dc.description.abstractWe have investigated the structural and lattice dynamical properties of XB2(X = Sc, V, Ti) by using first-principles total energy calculations. Specifically, the lattice parameters (a, c) of the stable phase, the bond lengths of X-B and B-B atoms, phonon dispersion curves and the corresponding density of states, and some thermodynamical quantities such as internal energy, entropy, heat capacity, and their temperature-dependent behaviours, are presented. The obtained results for structural parameters are in good agreement with the available experimental and other theoretical studies.
dc.description.sponsorshipGazi University Research-Project Unit [05/2008-42]
dc.description.sponsorshipThis work is supported by Gazi University Research-Project Unit under Project No: 05/2008-42.
dc.identifier.doi10.1016/j.ssc.2009.07.010
dc.identifier.endpage1848en_US
dc.identifier.issn0038-1098
dc.identifier.issue41-42en_US
dc.identifier.scopusqualityQ2
dc.identifier.startpage1843en_US
dc.identifier.urihttps://doi.org/10.1016/j.ssc.2009.07.010
dc.identifier.urihttps://hdl.handle.net/20.500.12451/5643
dc.identifier.volume149en_US
dc.identifier.wosWOS:000270690000027
dc.identifier.wosqualityN/A
dc.indekslendigikaynakWeb of Science
dc.indekslendigikaynakScopus
dc.language.isoen
dc.publisherPERGAMON-ELSEVIER SCIENCE
dc.relation.ispartofSOLID STATE COMMUNICATIONS
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı
dc.rightsinfo:eu-repo/semantics/closedAccess
dc.subjectHeat Capacity
dc.subjectPhonons
dc.subjectThermodynamic Properties
dc.titleLattice dynamical properties of ScB2, TiB2, and VB2 compounds
dc.typeArticle

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