Substitutional and interstitial Fe in hcp Zr, Ti, and Hf: Theory and experiments.

作者: A. Metz , S. Frota-Pessôa , J. Kapoor , D. Riegel , W. D. Brewer

DOI: 10.1103/PHYSREVLETT.71.3525

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摘要: Implanted Fe atoms in hcp Zr, Ti, and Hf occupy both substitutional interstitial lattice sites. In all three systems, is found to be strongly magnetic, while nonmagnetic. First principles calculations for the magnetic properties isomer shift have been carried out sites (by two independent methods) The theoretical predictions are excellent agreement with experimental results

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