English

Effect of Co substitution on Ni$_{2}$MnGe Heusler alloy: ab initio study

Materials Science 2023-07-19 v1

Abstract

Ab initio calculations shown that the Co substitution instead of Ni in Ni2_{2}MnGe with the L21_{1} crystallographic structure leads to a decrease of the lattice constant and an increase of the total magnetic moment of the Ni2x_{2-x}Cox_{x}MnGe compounds. The Mn(B) has the largest local moment above 3 μB3~\mu_{B} coupled parallel to moments on the Ni(A,C) and Co(A,C), which are found in the ranges of 0.19÷0.26 μB0.19\div0.26~\mu_{B} for Ni(A,C) and 1.03÷0.97 μB1.03\div0.97~\mu_{B} for Co(A,C) for studied range of xx. Using the results stemming from the total energy calculations, the values of bulk modulus and its pressure derivatives are estimated according to the Murnaghan EOS.

Keywords

Cite

@article{arxiv.1709.06490,
  title  = {Effect of Co substitution on Ni$_{2}$MnGe Heusler alloy: ab initio study},
  author = {M. Pugaczowa-Michalska},
  journal= {arXiv preprint arXiv:1709.06490},
  year   = {2023}
}

Comments

3 pages, 3 figures; The European Conference Physics of Magnetism 2017; submitted to Acta Physica Polonica A