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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 ...
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 ...