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Temperature dependent magnon-phonon coupling in bcc Fe from theory and experiment

F. Körmann, B. Grabowski, B. Dutta, T. Hickel, L. Mauger, B. Fultz, J. Neugebauer

Physical Review Letters, 113, 165503, (2014)

DOI: 10.1103/PhysRevLett.113.165503

Download: BibTEX

An ab initio based framework for quantitatively assessing the phonon contribution due to magnon-phonon interactions and lattice expansion is developed. The theoretical results for bcc Fe are in very good agreement with high-quality phonon frequency measurements. For some phonon branches, the magnon-phonon interaction is an order of magnitude larger than the phonon shift due to lattice expansion, demonstrating the strong impact of magnetic short-range order even significantly above the Curie temperature. The framework closes the previous simulation gap between the ferro-and paramagnetic limits.

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