Ai. Agafonov et Ea. Manykin, IMPURITY-INDUCED NARROW BANDS OF CONTINUOUS ELECTRONIC STATES IN DOPED SEMICONDUCTORS, Physical review. B, Condensed matter, 52(20), 1995, pp. 14571-14577
Impurity-induced modification of the density of electronic states in t
ransition-metal-doped semiconductors is studied. The model Hamiltonian
includes potential scattering of band electrons by impurity atoms ran
domly distributed in the host lattice, and hybridization between initi
al band states and d orbitals. The bare levels of the atoms are locate
d in the band gap. By applying multiple-scattering theory, configurati
on-averaged Green functions over the impurity ensemble are calculated
by using the Matsubara method in the short-range potential approximati
on. We demonstrate that for the defined attractive impurity potentials
the potential scattering results in band tail formation. A narrow hig
h-density band of free states within the gap have been found. The band
is caused by the hybridization that induces the following virtual ele
ctron transitions over the impurity ensemble: an initial impurity site
--> a band state --> another site --> a band state, etc. It is essent
ial that the main high-density peak of the localized states lies withi
n this band.