Structural and elastic properties of ZrC under high pressure

Materials Chemistry and Physics

Volumn 115, Issue 2-3, 2009, Pages 789-794

  Fu, Hongzhi ^a   Peng, Weimin ^a   Gao, Tao ^b  

^a LUOYANG NORMAL COLLEGE   (China)

^b SICHUAN UNIVERSITY   (China)

Author keywords

Ab initio calculations; Elastic properties; ZrC

Indexed keywords

AB INITIO CALCULATIONS; ANISOTROPY FACTORS; APPLIED PRESSURES; BULK MODULUS; DENSITY-FUNCTIONAL THEORIES; ELASTIC PROPERTIES; HEAT CAPACITIES; HIGH PRESSURES; LOCAL DENSITIES; NORM-CONSERVING PSEUDOPOTENTIALS; POISSON'S RATIOS; PRESSURE DEPENDENCES; QUASI-HARMONIC DEBYE MODELS; SHEAR MODULUS; THERMODYNAMIC PARAMETERS; YOUNG'S MODULUS; ZRC;

DENSITY FUNCTIONAL THEORY; ELASTIC MODULI; ELASTICITY; HIGH PRESSURE LIQUID CHROMATOGRAPHY; POISSON RATIO; SPECIFIC HEAT; THERMAL EXPANSION; THERMODYNAMICS; TIME VARYING SYSTEMS; ZIRCONIUM COMPOUNDS;

ELASTIC CONSTANTS;

EID: 64749094085     PISSN: 02540584     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.matchemphys.2009.02.031     Document Type: Article

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