Nonlocal pseudopotential calculations for the electronic structure of eleven diamond and zinc-blende semiconductors
Abstract
An empirical nonlocal pseudopotential scheme is employed to calculate the electronic structure of eleven semiconductors: Si, Ge, α-Sn, GaP, GaAs, GaSb, InP, InAs, InSb, ZnSe, and CdTe. Band structures, reflectivity spectra, electronic densities of states, and valence charge densities are presented and compared to experimental results. Improved optical gaps, optical critical-point topologies, valence-band widths, and valence charge distributions are obtained as compared to previous local pseudopotential results.
- Publication:
-
Physical Review B
- Pub Date:
- July 1976
- DOI:
- Bibcode:
- 1976PhRvB..14..556C