First-principles calculations of the structural, elastic and electronic properties of MNxC1−x (M = Ti, Zr, Hf; 0 ≤ x ≤ 1) carbonitrides at ambient and elevated hydrostatic pressure-Reference-Cited by-同舟云学术

First-principles calculations of the structural, elastic and electronic properties of MNxC1−x (M = Ti, Zr, Hf; 0 ≤ x ≤ 1) carbonitrides at ambient and elevated hydrostatic pressure

Published:2014-02 Issue: Volume:28 Page:1-8
ISSN:1293-2558
Container-title:Solid State Sciences
language:en
Short-container-title:Solid State Sciences

Author:

Krasnenko V.,Brik M.G.

Funder

European Regional Development Fund

European Social Fund's Doctoral Studies and Internationalization Programme DoRa

Publisher

Elsevier BV

Subject

Condensed Matter Physics,General Materials Science,General Chemistry

Reference45 articles.

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2. The Physics and Chemistry of Carbides, Nitrides and Borides,1996

3. Ab initio lattice dynamics and elastic constants of ZrC

4. Calculations of thermophysical properties of cubic carbides and nitrides using the Debye–Grüneisen model

5. Computational study of 5d transition metal mononitrides and monoborides using density functional method

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