Elastic properties of perovskite A TiO3 (A=Be, Mg, Ca, Sr, and Ba) and Pb B O3 (B=Ti, Zr, and Hf): First principles calculations

Journal of Applied Physics

Volumn 117, Issue 17, 2015, Pages

  Pandech, Narasak ^a,b,c   Sarasamak, Kanoknan ^d   Limpijumnong, Sukit ^a,b,c  

^a SURANAREE UNIVERSITY OF TECHNOLOGY   (Thailand)

^b SYNCHROTRON LIGHT RESEARCH INSTITUTE   (Thailand)

^c Thailand Ministry of Science and Technology   (Thailand)

^d KING MONGKUT'S INSTITUTE OF TECHNOLOGY LADKRABANG   (Thailand)

Author keywords

[No Author keywords available]

Indexed keywords

BERYLLIUM COMPOUNDS; ELASTIC CONSTANTS; ELASTICITY; HAFNIUM COMPOUNDS; LEAD COMPOUNDS; LOCAL DENSITY APPROXIMATION; MAGNESIUM COMPOUNDS; METALS; PEROVSKITE; POSITIVE IONS; ZIRCONIUM COMPOUNDS;

B-SITE CATIONS; DENSITY FUNCTIONALS; ELASTIC PARAMETERS; ELASTIC PROPERTIES; FIRST-PRINCIPLES APPROACHES; FIRST-PRINCIPLES CALCULATION; GENERALIZED GRADIENT APPROXIMATIONS; PEROVSKITE OXIDES;

CALCULATIONS;

EID: 84929086800     PISSN: 00218979     EISSN: 10897550     Source Type: Journal    
DOI: 10.1063/1.4919837     Document Type: Article

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