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arxiv: 1511.08625 · v2 · pith:CSQROMJ4new · submitted 2015-11-27 · ❄️ cond-mat.str-el

Magnetic properties of Fe_(1-x)Ni_x alloy from CPA+DMFT perspectives

classification ❄️ cond-mat.str-el
keywords magneticalloyexperimentalpropertiestemperaturesagreementanalysisapproximation
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We use a combination of the coherent potential approximation and dynamical mean field theory to study magnetic properties of the Fe$_{1-x}$Ni$_x$ alloy from a first principles. Calculated uniform magnetic susceptibilities have a Curie-Weiss-like behavior and extracted effective temperatures are in agreement with the experimental results. The individual squared magnetic moments obtained as function of nickel concentration follow the same trends as experimental data. An analysis of the ionic and spin weights shows a possibility of a high-spin to intermediate- and low-spin states transitions at high temperatures.

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