M. Ferhat et al., ELECTRONIC-STRUCTURE OF ALXGA1-XAS AND GAPXAS1-X ALLOYS MODIFIED VIRTUAL CRYSTAL APPROXIMATION CALCULATION USING SP(3)S(ASTERISK) BAND STRUCTURES, Materials science & engineering. B, Solid-state materials for advanced technology, 41(3), 1996, pp. 304-309
A simple light-binding sp(3)s model, which incorporates compositional
disorder as an effective potential, is used for the calculations of t
he electronic structures of the semiconducting alloys AlxGa1-xAs and G
aPxAs1-x. Our results for various interesting quantities, including ba
nd-gap horizons and crossover of the band gaps of these two systems, a
re compared with the available data; a good agreement is found. Copyri
ght (C) 1996 Elsevier Science S.A.