First-principles calculations for elastic properties of OsB2 under pressure

Physica B: Condensed Matter

Volumn 404, Issue 20, 2009, Pages 3608-3613

  Yang, Jun Wei ^a   Chen, Xiang Rong ^a,b   Luo, Fen ^a   Ji, Guang Fu ^c  

^a SICHUAN UNIVERSITY   (China)

^b INTERNATIONAL CENTRE FOR MATERIALS PHYSICS   (China)

^c RESEARCH CENTER OF LASER FUSION   (China)

Author keywords

Anisotropy; Density functional theory; Elastic constants; OsB2

Indexed keywords

BULK MODULUS; DENSITY FUNCTIONAL THEORY METHODS; ELASTIC ANISOTROPY; ELASTIC PROPERTIES; EXPERIMENTAL DATA; FIRST-PRINCIPLES CALCULATION; GENERALIZED GRADIENT APPROXIMATIONS; STRUCTURAL PARAMETER; SUPERHARD MATERIAL; THEORETICAL RESULT; ULTRASOFT PSEUDOPOTENTIALS;

ANISOTROPY; DEBYE TEMPERATURE; ELASTIC CONSTANTS; ELASTICITY; LOCAL DENSITY APPROXIMATION;

DENSITY FUNCTIONAL THEORY;

EID: 71749116223     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2009.06.006     Document Type: Article

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