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Structural, Electronic and Elastic Properties of Ycu From First Principles

dc.authorid Ugur, Sule/0000-0001-6710-8815
dc.authorid Soyalp, Fethi/0000-0002-4053-2189
dc.authorid Ugur, Gokay/0000-0003-4764-4113
dc.authorid Ellialtioglu, Recai/0000-0001-6100-5727
dc.authorscopusid 55908046100
dc.authorscopusid 55984447500
dc.authorscopusid 7004261573
dc.authorscopusid 8952053200
dc.authorscopusid 57213007347
dc.authorwosid Ellialtioglu, Recai/Abe-4844-2020
dc.authorwosid Ugur, Sule/B-6230-2016
dc.authorwosid Ugur, Gokay/B-6223-2016
dc.contributor.author Ugur, G.
dc.contributor.author Civi, M.
dc.contributor.author Ugur, S.
dc.contributor.author Soyalp, F.
dc.contributor.author Ellialtioglu, R.
dc.date.accessioned 2025-05-10T17:19:57Z
dc.date.available 2025-05-10T17:19:57Z
dc.date.issued 2009
dc.department T.C. Van Yüzüncü Yıl Üniversitesi en_US
dc.department-temp [Ugur, G.; Civi, M.; Ugur, S.] Gazi Univ, Dept Phys, TR-06500 Ankara, Turkey; [Soyalp, F.] Yuzuncu Yil Univ, Dept Phys, TR-65080 Van, Turkey; [Ellialtioglu, R.] Hacettepe Univ, Dept Engn Phys, TR-06800 Ankara, Turkey en_US
dc.description Ugur, Sule/0000-0001-6710-8815; Soyalp, Fethi/0000-0002-4053-2189; Ugur, Gokay/0000-0003-4764-4113; Ellialtioglu, Recai/0000-0001-6100-5727 en_US
dc.description.abstract The structural, electronic and elastic properties of YCu compound in the B2 (CsCl) phase were investigated using the density functional theory (DFT) within the generalized gradient approximation (GGA). The electronic density of states (DOS) obtained in this way accorded well with the results of a recent study utilizing the full-potential linearized augmented plane wave (FLAPW) method. We also found that the density of d-states at the Fermi energy was low. The calculated equilibrium properties such as lattice constant, bulk modulus and its first derivative, and the elastic constants were in good agreement with experimental and theoretical results. en_US
dc.description.woscitationindex Science Citation Index Expanded - Conference Proceedings Citation Index - Science
dc.identifier.doi 10.1016/S1002-0721(08)60310-5
dc.identifier.endpage 663 en_US
dc.identifier.issn 1002-0721
dc.identifier.issue 4 en_US
dc.identifier.scopus 2-s2.0-68949183522
dc.identifier.scopusquality Q1
dc.identifier.startpage 661 en_US
dc.identifier.uri https://doi.org/10.1016/S1002-0721(08)60310-5
dc.identifier.uri https://hdl.handle.net/20.500.14720/9946
dc.identifier.volume 27 en_US
dc.identifier.wos WOS:000269400600028
dc.identifier.wosquality Q1
dc.language.iso en en_US
dc.publisher Elsevier en_US
dc.relation.ispartof 1st International Conference on Rare Earth Materials (REMAT) -- SEP 21-26, 2008 -- Karpacz, POLAND en_US
dc.relation.publicationcategory Konferans Öğesi - Uluslararası - Kurum Öğretim Elemanı en_US
dc.rights info:eu-repo/semantics/closedAccess en_US
dc.subject Ycu en_US
dc.subject Electronic Band Structure en_US
dc.subject Density Of States en_US
dc.subject Elastic Constants en_US
dc.subject Bulk Modulus en_US
dc.subject Ab Initio en_US
dc.subject Rare Earths en_US
dc.title Structural, Electronic and Elastic Properties of Ycu From First Principles en_US
dc.type Conference Object en_US

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