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Li-doping effect on the energy structure of KTaO.sub.3
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SYSNO ASEP 0133303 Document Type J - Journal Article R&D Document Type Journal Article Subsidiary J Ostatní články Title Li-doping effect on the energy structure of KTaO.sub.3 Author(s) Tupitsyn, I. I. (RU)
Deineka, Alexander (FZU-D)
Trepakov, V. A. (RU)
Jastrabík, Lubomír (FZU-D) RID, ORCID
Kapphan, S. (DE)Source Title Ferroelectrics. - : Taylor & Francis - ISSN 0015-0193
Roč. 237, - (2000), s. 313-320Number of pages 8 s. Language eng - English Country GB - United Kingdom Subject RIV BM - Solid Matter Physics ; Magnetism CEZ AV0Z1010914 - FZU-D Annotation The electronic structure calculation of pure and Li doped KTaO_3 is performed by first-principle CASTEP code and INDO (semiempirical Hartree-Fock) methods. In ab initio calculations based on density functional theory the plane wave basis and ab initio psudopotentials have been used. Workplace Institute of Physics Contact Kristina Potocká, potocka@fzu.cz, Tel.: 220 318 579 Year of Publishing 2002
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