Screened moments and absence of ferromagnetism in FeAl
Physical Review B 92(20)
Article 2015 English
Authors
AG
Anna Galler
CT
Ciro Taranto
MW
Markus Wallerberger
Abstract
1 min read
While the stoichiometric intermetallic compound FeAl is found to be paramagnetic in experiment, standard band-theory approaches predict the material to be ferromagnetic. We show that this discrepancy can be overcome by a better treatment of electronic correlations with density-functional plus dynamical mean-field theory. Our results show no ferromagnetism down to $100\phantom{\rule{0.16em}{0ex}}\mathrm{K}$ and since the susceptibility is decreasing at the lowest temperatures studied we also do not expect ferromagnetism at even lower temperatures. This behavior is found to originate from temporal quantum fluctuations that screen short-lived local magnetic moments of $1.6\phantom{\rule{0.16em}{0ex}}{\ensuremath{\mu}}_{\mathrm{B}}$ on Fe.
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