Structural, magnetic, and electronic properties of Fe/Au monatomic multilayers

An Fe/Au monatomic multilayer, consisting of alternating single Fe and Au layers, has been studied by means of the self-consistent full-potential linearized augmented plane wave method. We show by total energy minimization that this artificial thin film is in the tetragonal {ital L}1{sub 0} ordered structure with the ratio of the interlayer spacing to the intralayer lattice constant at 0.865. In this configuration, the magnetic moment in each monolayer, the spin-polarized electronic density of states, and the corresponding band structure are calculated. The results are discussed in connection with recent experiments. {copyright} {ital 1996 The American Physical Society.}