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Volumn 54, Issue 1, 2012, Pages 16-22

The structure, elastic, electronic properties and Debye temperature of M 2AlC (MV, Nb and Ta) under pressure from first-principles

(3) Wang, Haizhou a Zhan, Yongzhong a Pang, Mingjun a

a GUANGXI UNIVERSITY (China)

Author keywords

Compounds; First principles; M 2AlC; Pressure

Indexed keywords

ATOMIC NUMBERS; COMPOUNDS; DENSITY OF STATE; ELASTIC PROPERTIES; FIRST-PRINCIPLES; GENERALIZED GRADIENT APPROXIMATIONS; M 2ALC; MECHANICALLY STABLE; POISSON'S RATIO; SOUND VELOCITIES; STRUCTURAL DATA; TERNARY COMPOUNDS; THEORETICAL RESULT; UNIT CELLS; VALENCE ELECTRON; YOUNG'S MODULUS;

ATOMS; CALCULATIONS; DEBYE TEMPERATURE; DEFORMATION; DENSITY FUNCTIONAL THEORY; ELASTIC MODULI; ELASTICITY; ELECTRONIC PROPERTIES; NIOBIUM; POISSON RATIO; PRESSURE; TANTALUM; TERNARY ALLOYS; TERNARY SYSTEMS;

NIOBIUM COMPOUNDS;

EID: 83155191162 PISSN: 09270256 EISSN: None Source Type: Journal
DOI: 10.1016/j.commatsci.2011.11.003 Document Type: Article

Times cited : (41)

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