s−d-band conductivity in liquid La

Abstract
The electrical conductivity of liquid La is computed numerically from a linear combination of atomic orbitals description of a cluster of 364 atoms. Contrary to an earlier suggestion that the conduction should be mainly due to s states, we find that the d states are dominant. Although the diffusivity of s states is about 2.5 times greater than that of d states, the density of d states is so much greater than the density of s states that the conduction is mainly by d states.