Phonon density of states of single-crystal SrF e2 A s2 across the collapsed phase transition at high pressure

Academic Article

Abstract

  • To help our understanding of the structural and superconducting transitions in ferropnictides, partial phonon density of states (PDOS) of iron in a single-crystal SrFe2As2 pnictide have been investigated from both out-of-plane and in-plane polarizations with respect to the basal plane of the crystal structure using nuclear resonant inelastic x-ray scattering in a high-pressure diamond anvil cell at ambient temperature. The partial PDOS of iron in the pnictide crystal changes dramatically at approximately 8 GPa, which can be associated with the tetragonal (T) to collapsed tetragonal (CT) isostructural transition as evidenced in high-pressure x-ray diffraction measurements and theoretical calculations. Across the T-CT phase transition, analysis of the PDOS spectra shows a rapid stiffening of the optical phonon modes and a dramatic increase of the Lamb-Mössbauer factor (fLM) and mean force constant which can be associated with the rapid decrease of the c axis and the anomalous expansion of the a axis. Theoretically calculated Fe partial PDOS and lattice parameters of SrFe2As2 further reveal the strong correlation between the lattice parameters and phonons. Our results show that the T-CT transition can induce significant changes in the vibrational, elastic, and thermodynamic properties of SrFe2As2 single crystal at high pressure.
  • Authors

    Published In

  • Physical Review B  Journal
  • Physical Review B  Journal
  • Digital Object Identifier (doi)

    Author List

  • Wang YQ; Lu PC; Wu JJ; Liu J; Wang XC; Zhao JY; Bi W; Alp EE; Park CY; Popov D
  • Volume

  • 94
  • Issue

  • 1