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Phys. Rev. Lett. 91, 157201 (2003) [4 pages]

Origin of Magnetic Anisotropy of Gd Metal

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M. Colarieti-Tosti1,2, S. I. Simak1, R. Ahuja1, L. Nordström1, O. Eriksson1, D. Åberg1,3, S. Edvardsson3, and M. S. S. Brooks1,2
1Department of Physics, Uppsala University, Box 530, S-751 21 Uppsala, Sweden
2European Commission, Joint Research Centre, Institute for Transuranium Elements, Postfach 2340, D-76125 Germany
3Department of Physical Electronics/Photonics, Mitthögskolan, Sundsvall, Sweden

Received 19 December 2002; published 8 October 2003

Using first-principles theory, we have calculated the energy of Gd as a function of spin direction, θ, between the c and a axes and found good agreement with experiment for both the total magnetic anisotropy energy and its angular dependence. The calculated low temperature direction of the magnetic moment lies at an angle of 20° to the c axis. The calculated magnetic anisotropy energy of Gd metal is due to a unique mechanism involving a contribution of 7.5  μeV from the classical dipole-dipole interaction between spins plus a contribution of 16  μeV due to the spin-orbit interaction of the conduction electrons. The 4f spin polarizes the conduction electrons via exchange interaction, which transfers the magnetic anisotropy of the conduction electrons to the 4f spin.

© 2003 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevLett.91.157201
DOI:
10.1103/PhysRevLett.91.157201
PACS:
75.30.Gw, 71.20.Eh, 75.10.Lp