Electronic structure of titanium. III
Abstract
The band structure and Fermi surface of titanium have been calculated using the augmented-plane-wave method. The present calculation, carried out using a potential that is derived from the atomic configuration 3d3 4s1, is compared with previous results obtained by using the configuration 3d2 4s2.
- Publication:
-
Physical Review B
- Pub Date:
- February 1974
- DOI:
- 10.1103/PhysRevB.9.1993
- Bibcode:
- 1974PhRvB...9.1993W