Browsing by Subject "Elastic properties"
Now showing items 1-5 of 5
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FP-APW + lo calculations of the elastic properties in zinc-blende III-P compounds under pressure effects
(Elsevier B.V., 2009-04)The effect of high-pressures on the structural and elastic properties of XP zinc-blende compounds, with X = B, Al, Ga and In, has been investigated using the full-potential augmented plane wave plus local orbitals method ... -
Full potential study of the elastic, electronic, and optical properties of spinels MgIn2S4 and CdIn2S4 under pressure effect
(Elsevier Inc., 2010-12)The structural, elastic, electronic, and optical properties of cubic spinel MgIn2S4 and CdIn2S4 compounds have been calculated using a full relativistic version of the full-potential linearized-augmented plane wave with ... -
Investigated optical and elastic properties of Porous silicon: Theoretical study
(Elsevier Ltd., 2011-08)Compatibility between experimental and theoretical works is achieved. Empirical Pseudopotential Method (EPM) is used to calculate the energy gap of Si which is found to be indirect. Features such as refractive index, optical ... -
Prediction study of the structural and elastic properties for the cubic skutterudites LaFe4A12 (A = P, As and Sb) under pressure effect
(Elsevier Ltd., 2010-10)We have performed accurate ab initio total energy calculations using the full-potential linear augmented plane wave plus local orbitals method with the local density approximation for the exchangecorrelation potential ... -
Structural, elastic, electronic and thermodynamic properties of the filled skutterudite CeOs4Sb12 determined by density functional theory
(Elsevier Ltd., 2013)Structural, elastic, electronic and thermodynamic properties of the ternary cubic filled skutterudite CeOs4Sb12 compound were calculated using the full-potential linear muffin-tin orbital implementation of density functional ...