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First Principles Study of the Structural, Elastic, Electronic and Phonon Properties of CdX2O4 (X=Al, Ga, In) Spinel-Type Oxides
(AMER INST PHYSICS, 2014)
We have performed ab-initio calculations of the structural, electronic, elastic and dynamical properties for the spinel compounds CdX2O4 (X=Al, Ga, In) using the plane wave pseudo-potential method within the generalized ...
Structural, Elastic, Electronic and Phonon Properties of SnX2O4 (X=Mg, Zn, Cd) Spinel from Density Functional Theory
(AMER INST PHYSICS, 2014)
First-principle calculations of structural, electronic, elastic and phonon properties of SnMg2O4, SnZn2O4 and SnCd2O4 compounds are presented, using the pseudo-potential plane waves approach based on density functional ...