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Doping-dependent Fe phonon dynamics in LaFeAsO1−xHx studied by Fe57 nuclear resonant inelastic scattering

Shiro Kawachi1,*, Haruhiro Hiraka2, Jun-ichi Yamaura3, Soshi Iimura4, Hiroki Nakamura5, Satoshi Tsutsui6,7, Yoshitaka Yoda6, Masahiko Machida5, Hideo Hosono8,4 et al.

Hisao Kobayashi1

  • *Contact author: kawachi@sci.u-hyogo.ac.jp

Phys. Rev. B 113, 024519 – Published 30 January, 2026

DOI: https://doi.org/10.1103/7zd9-5t9z

Abstract

To investigate the phonon dynamics of iron in the heavily hydride-ion-substituted region of LaFeAsO1−xHx (x>0.2), Fe57 nuclear resonant inelastic scattering measurements were performed over a wide temperature range from 5 to 300 K on two polycrystalline samples with x=0.35 and 0.51, which exhibit superconducting and antiferromagnetic ground states, respectively. The resulting inelastic scattering spectra revealed distinct differences between the two compositions. The Fe phonon density of states (PDOS) exhibits a pronounced peak at 15 meV for x=0.35, whereas this peak is absent in x=0.51. Density functional theory calculations support the interpretation that the PDOS peak at 15 meV is associated with the optical vibrational modes of Fe atoms along the nearest-neighbor direction, mediated by As atoms. The calculations further suggest that the suppression of the PDOS peak at 15 meV for x=0.51 originates from in-plane electronic inequivalence. These findings suggest that signatures of electronic nematicity may persist over a wide temperature range in the x=0.51 composition, which exhibits magnetic and structural order, whereas such signatures are almost absent in the superconducting x=0.35 composition.

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