Fermi surface reconstruction due to orthorhombic distortion in the Dirac semimetal
Phys. Rev. B 111, 214115 – Published 20 June, 2025
DOI: https://doi.org/10.1103/lk8w-7hkj
Abstract
A Dirac semimetal with magnetic atoms as constituents delivers an interesting platform to investigate the interplay of Fermi surface (FS) topology, electron correlation, and magnetism. One such family of semimetals is (), which is being actively studied due to the intertwined spin and charge degrees of freedom. Here, we investigate the relationship between the magnetic/crystal structures and FS topology of using single crystal x-ray diffraction, neutron scattering, magnetic susceptibility, magnetotransport measurements, and complimentary density functional theory (DFT) calculations. Contrary to previous reports, the x-ray and neutron diffraction reveal that crystallizes in an orthorhombic structure with a notable antiphase displacement of the magnetic Mn ions that increases in magnitude upon cooling. As a result of this orthorhombicity, first-principles DFT calculation reveals a reduced Brillouin zone and more anisotropic FS of compared to . Moreover, the hole-type carrier density drops by two orders of magnitude as orders antiferromagnetically, indicating band folding in a magnetic ordered state. In addition, the Landau level fan diagram yields a nontrivial nature of the Shubnikov–de Haas quantum oscillation frequency arising from the Dirac-like Fermi pocket. These results imply that is an ideal platform to explore the interplay of subtle lattice distortion, magnetic order, and topological transport arising from relativistic quasiparticles.