Structural, dynamical and thermodynamic properties of CdXP2 (X = Si, Ge) from first principles
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DOI: 10.1007/s12648-017-1109-9
Abstract: The structural, elastic, dynamical and thermodynamic properties of CdXP2 (X = Si, Ge) with chalcopyrite semiconductors have been calculated by using the projector augmented wave method within the generalized gradient approximation. The obtained lattice constants and elastic… read more here.
Keywords: thermodynamic properties; properties cdxp2; structural dynamical; dynamical thermodynamic ... See more keywords