Complex magnetism of B20-MnGe: from spin-spirals, hedgehogs to monopoles

J Phys Condens Matter. 2019 Dec 4;31(48):485801. doi: 10.1088/1361-648X/ab38a0. Epub 2019 Aug 5.

Abstract

B20 compounds are the playground for various non-trivial magnetic textures such as skyrmions, which are topologically protected states. Recent measurements on B20-MnGe indicate no clear consensus on its magnetic behavior, which is characterized by the presence of either spin-spirals or three-dimensional objects interpreted to be a cubic lattice of hedgehogs and anti-hedgehogs. Utilizing a massively parallel linear scaling all-electron density functional algorithm, we find from full first-principles simulations on cells containing thousands of atoms that upon increase of the compound volume, the state with lowest energy switches across different magnetic phases: ferromagnetic, spin-spiral, hedgehog and monopole.