I. Cabria et al., Microscopic origin of the magnetocrystalline anisotropy energy of ferromagnetic-semiconductor multilayers, EUROPH LETT, 51(2), 2000, pp. 209-215
Results of a detailed study of the spin-orbit-induced electronic magnetocry
stalline anisotropy energy (MAE) of Fe/GaAs (001) ferromagnetic-semiconduct
or multilayers using the first-principles spin-polarized relativistic (SPR)
linear-muffin-tin-orbital (LMTO) method are presented. For a further analy
sis, the spin-orbit-induced orbital moments have been calculated in a spin-
resolved way, in addition. This allowed to check the relationship between t
he MAE and the orbital moments suggested by Bruno and van der Laan. Accordi
ng to that relationship, the microscopic origin of the electronic MAE of th
ese multilayers is mainly due (similar to 80%) to a delicate rearrangement
of the occupations of certain 3d minority spin levels at the interface Fe l
ayers.