Effect of lattice distortion on the band structure and magnetism in the annealed kagome magnet FeGe
Phys. Rev. B 113, 085146 – Published 25 February, 2026
DOI: https://doi.org/10.1103/ykhd-c334
Abstract
In this work, combined with the optical spectroscopy and the first-principles calculations, we investigated the effect of lattice distortion on the band structure and magnetism of FeGe annealed at different temperatures. Our observations reveal that the sample annealed at experienced dramatic change in optical conductivity following the charge-density-wave (CDW) transition. Specifically, a substantial portion of the spectral weight (SW) in the low-energy region was redistributed to the high-energy region , suggesting a reconstruction of the band structure. The sample annealed at did not exhibit a CDW transition, but it exhibited the same tendency of SW transfer from 300 to 5 K progressively. Through the first-principles calculations, we ascribed the band reconstruction to Ge1 atoms' dimerization along the axis and analyzed its affection to the magnetism. On the other hand, even though the CDW transition is absent in annealed sample, the high-temperature annealing induced lattice distortion, resulting in the same optical properties, further emphasized that the band reconstruction and the enhanced magnetism primarily come from the displacement of Ge1 atoms.