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First Principle Calculation of Electronic Band Structure and Optical Properties of Kio3

dc.authorscopusid 55921648100
dc.authorscopusid 26654044300
dc.contributor.author Akkus, Harun
dc.contributor.author Erding, Bahattin
dc.date.accessioned 2025-05-10T17:19:47Z
dc.date.available 2025-05-10T17:19:47Z
dc.date.issued 2009
dc.department T.C. Van Yüzüncü Yıl Üniversitesi en_US
dc.department-temp [Akkus, Harun; Erding, Bahattin] Yuzuncu Yil Univ, Dept Phys, TR-65080 Van, Turkey en_US
dc.description.abstract The electronic band structure and optical properties of the ferroelectric single crystal KIO3 have been investigated using the density functional methods. The calculated band structure for KIO3 evidences that the crystal has a direct band gap with a value of 2.83 eV. The structural optimization has been performed. The real and imaginary parts of dielectric function, energy-loss function for volume and surface, and refractive index are calculated along the crystallographic axes. en_US
dc.description.sponsorship TUBITAK en_US
dc.description.sponsorship This research was supported in part by TUBITAK through TR-Grid e-Infrastructure Project. TR-Grid systems are hosted by TUBITAK ULAKBIM, Middle East Technical University, Pamukkale University, Cukurova University, Erciyes University, Bogazici University, and Istanbul Technical University of Turkey. Visit http://www.grid.org.tr for more information. en_US
dc.description.woscitationindex Science Citation Index Expanded
dc.identifier.doi 10.1142/S021797920905239X
dc.identifier.endpage 2412 en_US
dc.identifier.issn 0217-9792
dc.identifier.issn 1793-6578
dc.identifier.issue 10 en_US
dc.identifier.scopus 2-s2.0-67549105054
dc.identifier.scopusquality Q2
dc.identifier.startpage 2405 en_US
dc.identifier.uri https://doi.org/10.1142/S021797920905239X
dc.identifier.uri https://hdl.handle.net/20.500.14720/9907
dc.identifier.volume 23 en_US
dc.identifier.wos WOS:000265940800012
dc.identifier.wosquality Q2
dc.language.iso en en_US
dc.publisher World Scientific Publ Co Pte Ltd en_US
dc.relation.publicationcategory Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı en_US
dc.rights info:eu-repo/semantics/closedAccess en_US
dc.subject Ferroelectrics en_US
dc.subject Dielectric Response en_US
dc.subject Electronic Band Structure en_US
dc.subject Optical Properties en_US
dc.title First Principle Calculation of Electronic Band Structure and Optical Properties of Kio3 en_US
dc.type Article en_US

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