| Title: | Spin-polarizovaný antiferromagnetický CaCoSO monokrystal: první principielní studie Spin-polarized antiferromagnetic CaCoSO single crystal: First principles study |
| Authors: | Al-Jaary, Ali H. Reshak |
| Citation: | AL-JAARY, A. H. R. Spin-polarized antiferromagnetic CaCoSO single crystal: First principles study. Journal of Alloys and Compounds, 2017, roč. 711, č. JUL 15, s. 229-234. ISSN 0925-8388. |
| Issue Date: | 2017 |
| Publisher: | Elsevier |
| Document type: | článek article |
| URI: | http://hdl.handle.net/11025/29215 https://www.scopus.com/record/display.uri?origin=resultslist&eid=2-s2.0-85016968125 |
| ISSN: | 0925-8388 |
| Keywords: | spin-polarizace;elektronické materiály;magnetický moment |
| Keywords in different language: | spin-polarization;electronic materials;magnetic moment |
| Abstract: | Komplexní spin-polarizované výpočty byly provedeny pro nedávno syntetizovaný antiferromagnetický CaCoSO monokrystal založený na metodě full-potential plus Hubbard Hamiltonian. Experimentální mřížkové parametry monokrystalu CaCoSO byly optimalizovány a pokusné atomové polohy byly uvolněny tak, aby se minimalizovaly sílypůsobící na atomy |
| Abstract in different language: | Comprehensive spin-polarized calculations were performed for the recently synthesized antiferromagnetic CaCoSO single crystal based on the full-potential method plus Hubbard Hamiltonian. The experimental lattice parameters of the CaCoSO single crystal were optimized and the experimental atomic positions were relaxed so as to minimize the forces acting on the atoms |
| Rights: | Plný text není přístupný. © Elsevier |
| Appears in Collections: | Články / Articles (CTM) OBD |
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|---|---|---|---|
| Ali-CaCOSO-JALCOM-17.pdf | 2,65 MB | Adobe PDF | View/Open Request a copy |
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