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Non-Collinear Instability of Ferromagnetic Mn5Ge3 compound |
Alessandro Stroppa 1, Maria Peressi |
1. Università di Trieste, Trieste, Italy |
Abstract |
Mn5Ge3 thin films epitaxially grown on Ge(111) exhibit metallic conductivity and strong ferromagnetism up to about 300 K. Recent experiments suggest a non-collinear spin structure. In order to gain deep insights into the magnetic structure of this compound, we have performed fully unconstrained ab-initio pseudopotential calculations within Density Functional Theory, investigating the different magnetic states corresponding to Collinear (C) and Non-Collinear (NC) spin configurations. We focus on their relative stability under pressure and strain field. Under pressure, the C and NC configurations are degenerate, suggesting the possible occurence of accidental magnetic degeneracy also in Mn5Ge3 real samples. We found a continuos transition from a ferromagnetic C low-spin state at small volums to a NC high-spin state at higher volumes. Remarkably, the degeneracy is definitely removed under the effect of uniaxial strain: in particular, NC spin configuration is favoured under tensile uniaxial strain. |
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Presentation: Oral at E-MRS Fall Meeting 2006, Symposium E, by Alessandro StroppaSee On-line Journal of E-MRS Fall Meeting 2006 Submitted: 2006-05-26 09:30 Revised: 2009-06-07 00:44 |