Abstract
In considering the alloys on the basis of a realistic muffin-tin Hamiltonian, the most notable feature of the electronic spectra is found to be the appearance of an impurity band below the host conduction band. In accord with relevant experiments, a Fermi surface is predicted to grow at approximately half the rigid-band rate for at.% Ge and essentially at the rigid-band rate for at.% Ge. This effect is related to a transition in the nature of states associated with the impurity band; these states are localized atomic -like states for and become delocalized in concentrated alloys.
- Received 3 March 1981
DOI:https://doi.org/10.1103/PhysRevLett.48.113
©1982 American Physical Society