First-principles study of optical, elastic anisotropic and thermodynamic properties of TiN under high temperature and high pressure

The optical, elastic anisotropic and thermodynamic properties of TiN in the NaCl (B1) structure are analyzed in detail in the temperature range from 0 to 2000 K and the pressure range from 0 to 20 GPa. From the calculated dielectric constants, a first order isostructural phase transition between 2...

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Datum:2017
Hauptverfasser: Yang, R., Zhu, C., Wei, Q., Xiao, K., Du, Z.
Format: Artikel
Sprache:English
Veröffentlicht: Інститут фізики конденсованих систем НАН України 2017
Schriftenreihe:Condensed Matter Physics
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Назва журналу:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Zitieren:First-principles study of optical, elastic anisotropic and thermodynamic properties of TiN under high temperature and high pressure / R. Yang, C. Zhu, Q. Wei, K. Xiao, Z. Du // Condensed Matter Physics. — 2017. — Т. 20, № 2. — С. 23601: 1–10 . — Бібліогр.: 28 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine