Magnetocrystalline anisotropy of Co-Pd interfaces
- 1 December 1993
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 48 (21) , 15886-15892
- https://doi.org/10.1103/physrevb.48.15886
Abstract
The interface magnetocrystalline anisotropy (MCA) of a Pd/Co/Pd sandwich is calculated by employing the recently proposed state-tracking approach and the full-potential linearized augmented-plane-wave energy band structure. The strong positive (perpendicular) Co-Pd interface MCA arises from the hybridization between the out-of-plane Co bonding xz(yz) states with the interface Pd atom: the large d-d bonding strength and high energy of the Pd d states shifts a substantial component of these Co states (bands) above the Fermi energy. Comparisons with a previous study on the Co-Cu interface makes clear that the difference between the effects of two groups of substrates (Cu, Ag versus Pd, Au, etc.) depends on the interface bonding strength and the position of the d states of the interface atoms—as is qualitatively revealed by an analysis based on the use of an effective-ligand-interaction model.Keywords
This publication has 13 references indexed in Scilit:
- First-principles theory of surface magnetocrystalline anisotropy and the diatomic-pair modelPhysical Review B, 1993
- Theoretical studies of the magneto-crystalline anisotropy: Monolayer CoJournal of Applied Physics, 1993
- State-tracking first-principles determination of magnetocrystalline anisotropyPhysical Review Letters, 1993
- Magnetic anisotropies of ultrathin Co(001) films on Cu(001)Physical Review Letters, 1992
- Electronic structure theory of surface, interface and thin-film magnetismJournal of Magnetism and Magnetic Materials, 1991
- Structural, electronic and magnetic properties of Co/Pd(111) and Co/Pt(111)Journal of Magnetism and Magnetic Materials, 1991
- Magnetic anisotropy of multilayersJournal of Magnetism and Magnetic Materials, 1991
- First-principles calculation of the magnetic anisotropy energy of (Co/(XmultilayersPhysical Review B, 1990
- Magnetic anisotropy in low-dimensional ferromagnetic systems: Fe monolayers on Ag(001), Au(001), and Pd(001) substratesPhysical Review B, 1990
- Total-energy differences and eigenvalue sumsPhysical Review B, 1985