First-principles exchange interactions in Fe, Ni, and Co

Using a multiple-scattering approach and the local-density and rigid-spin approximations, the exchange interactions are calculated for Fe, Ni, and Co, and the spin-wave spectrum obtained. The interactions contributing to the spin-wave spectrum are found to be rather long-ranged. The exchange paramet...

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Veröffentlicht in:Journal of Applied Physics 1999-04, Vol.85 (8), p.4827-4829
Hauptverfasser: van Schilfgaarde, M., Antropov, V. P.
Format: Artikel
Sprache:eng
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Zusammenfassung:Using a multiple-scattering approach and the local-density and rigid-spin approximations, the exchange interactions are calculated for Fe, Ni, and Co, and the spin-wave spectrum obtained. The interactions contributing to the spin-wave spectrum are found to be rather long-ranged. The exchange parameters are calculated as a function of band filling, and predict transition to antiferromagnetic behavior for electron-deficient alloys of bcc Fe and fcc Co.
ISSN:0021-8979
1089-7550
DOI:10.1063/1.370495