Tight-binding description of TiCx

• Veröffentlicht in: Condensed Matter Physics
• Datum: 2004
• Hauptverfasser: Ivashchenko, V.I., Turchi, P.E.A., Shevchenko, V.I., Ivashchenko, L.A., Porada, O.K.
• Format: Artikel
• Sprache: Englisch
• Veröffentlicht: Інститут фізики конденсованих систем НАН України 2004
• Online Zugang: https://nasplib.isofts.kiev.ua/handle/123456789/118890
• Назва журналу: Digital Library of Periodicals of National Academy of Sciences of Ukraine
• Zitieren: Tight-binding description of TiCx / V.I. Ivashchenko, P.E.A. Turchi, V.I. Shevchenko, L.A. Ivashchenko, O.K. Porada // Condensed Matter Physics. — 2004. — Т. 7, № 1(37). — С. 79-100. — Бібліогр.: 70 назв. — англ.

A parametrized non-orthogonal tight-binding (TB) method combined with the coherent-potential-approximation is applied to the study of the electronic structure of disordered off-stoichiometric TiCx, the lattice relaxation and the electronic spectra of the TiC (001) surface, the local relaxation and e...