Structural and thermodynamic properties of antiperovskite SbNMg3

Computational Materials Science

Volumn 43, Issue 4, 2008, Pages 938-942

  Belaroussi, T ^a   Amrani, B ^b   Benmessabih, T ^a,b   Iles, N ^b   Hamdache, F ^a  

^a UNIVERSITÉ DES SCIENCES ET DE LA TECHNOLOGIE D ORAN MOHAMED BOUDIAF   (Algeria)

^b UNIVERSITÉ DE MASCARA   (Algeria)

Author keywords

FP LAPW; Quasi harmonic Debye model; SbNMg3; Thermodynamic properties

Indexed keywords

ELASTIC CONSTANTS; ELASTIC MODULI; LATTICE CONSTANTS; PROBABILITY DENSITY FUNCTION; THERMODYNAMIC PROPERTIES;

ANTIPEROVSKITE; AUGMENTED PLANE WAVE PLUS LOCAL ORBITAL; BULK MODULUS; DENSITY-FUNCTIONAL; FP-LAPW; FP-LAPW + LO; GENERALIZED GRADIENT APPROXIMATIONS; PRESSURE DERIVATIVES; QUASI-HARMONIC DEBYE MODEL; SBNMG3;

DENSITY FUNCTIONAL THEORY;

EID: 53149091707     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2008.02.006     Document Type: Article

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