Elastic and optical properties of BeS, BeSe and BeTe under pressure
Résumé
We have performed the first principles full-potential linearized augmented plane wave calculations (FP-LAPW) with density functional theory in local density approximations (LDA), in aim to determine and to predict the pressure dependence of structural and optical properties of zinc-blende BeS, BeSe and BeTe compounds. The elastic constant, refractive index and its variation with hydrostatic pressure are well described. © 2006 Elsevier Ltd. All rights reserved.