Self-consistent electronic structures of MgO and SrO
Abstract
The LMTO-method is used to calculate the band structure of the alkaline-earth oxides MgO and SrO. The cohesive energy and equilibrium lattice constant are also calculated. The results are compared with experiments and other theoretical calculations.
- Publication:
-
Solid State Communications
- Pub Date:
- July 1985
- DOI:
- 10.1016/0038-1098(85)90622-2
- Bibcode:
- 1985SSCom..55..351T