Rq. Wu et Aj. Freeman, MAGNETISM AT METAL-CERAMIC INTERFACES - EFFECTS OF A AU OVERLAYER ON THE MAGNETIC-PROPERTIES OF FE MGO(001)/, Journal of magnetism and magnetic materials, 137(1-2), 1994, pp. 127-133
In the search for a benign magnetic substrate with which to explore 2D
magnetism in transition metal monolayer, MgO(001) has emerged from st
udies of the metal-ceramic interaface as a prime candidate. Since Au o
verlayers are now used to prevent oxidation, we have determined their
effects on the electronic and magnetic properties of Fe/MgO(001) by me
ans of first principles calculations using the full potential lineariz
ed augmented plane wave method. Some Fe-Au hybridization is found whic
h diminishes the giant spin moment in Fe/MgO(001) by 0.14mu(B). In tur
n, the Fe layer induces a sizable magnetic moment at the Au site, name
ly, a 0.069mu(B) spin moment and a 0.042mu(B) orbital moment. A substa
ntial magnetic circular dichroism signal is predicted for Au, which in
vites experimental verification.