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Title: Electronic and magnetic properties of Si substituted Fe3Ge

Journal Article · · Journal of Applied Physics
DOI:https://doi.org/10.1063/1.4931574· OSTI ID:1235828
 [1];  [1];  [1]
  1. Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)

We studied the effect of Si substitution in the hexagonal Fe3Ge, using first principles calculations. We also find the low temperature magnetic anisotropy in this system to be planar and originating mostly from the spin-orbit coupling in Fe-d states. Reduction of the unitcell volume reduces the magnitude of in-plane magnetic anisotropy, eventually turning it positive which reorients the magnetic moments to the axial direction. Substituting Ge with the smaller Si ions also increases the anisotropy, potentially enhancing the region of stability of the axial magnetization, which is beneficial for magnetic applications such as permanent magnets. Finally, our experimental measurements on samples of Fe3Ge1-xSix confirm these predictions and show that substitution of about 6% of the Ge with Si increases by approximately 35 K the temperature range over which anisotropy is uniaxial.

Research Organization:
Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)
Sponsoring Organization:
USDOE
Grant/Contract Number:
AC05-00OR22725
OSTI ID:
1235828
Alternate ID(s):
OSTI ID: 1334450; OSTI ID: 1420724
Journal Information:
Journal of Applied Physics, Vol. 118, Issue 12; ISSN 0021-8979
Publisher:
American Institute of Physics (AIP)Copyright Statement
Country of Publication:
United States
Language:
English
Citation Metrics:
Cited by: 12 works
Citation information provided by
Web of Science

References (9)

Ferromagnetism of Fe3Sn and Alloys journal November 2014
The crystallographic phases and magnetic properties of Fe2MnSi1−xGex journal May 2003
Magnetic properties of hexagonal and cubic Fe 3 Ge journal November 1976
Magnetocrystalline anisotropy of Fe3Ge single crystal: Effect of pressure and Mn substitution for Fe journal August 2004
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set journal October 1996
Projector augmented-wave method journal December 1994
Shape Controlling Synthesis— Formation of Fe3Si by the Reaction of Iron with Silicon Tetrachloride and Crystal Structure Refinement journal September 2003
Magnetic anisotropic effects and electronic correlations in MnBi ferromagnet journal August 2014
Theoretical study on the role of dynamics on the unusual magnetic properties in MnBi journal November 2014

Cited By (1)

Tuning magnetocrystalline anisotropy by cobalt alloying in hexagonal Fe3Ge1 journal September 2018

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