journal article·2004-05

First-principles study of the interplay between magnetism and phase equilibria in Fe–Co alloys

A. Dı́az-Ortiz, R. Drautz, M. Fähnle, H. Dosch

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Abstract

Abstract The effect of magnetism on the ground state structures has been investigated by means of first-principles, density-functional calculations. In addition to the experimentally observed CsCl-type ground-state structure for FeCo stoichiometric alloys, our spin-polarized calculations predict several new ordered structures for iron-rich alloys. In particular, our results show that Fe 3 Co alloys are energetically stable for a number of ordered structures.
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Research context

OpenAlex topics: Magnetic Properties and Applications · Magnetic properties of thin films · Heusler alloys: electronic and magnetic properties

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