2009
DOI: 10.1103/physrevb.80.165108
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Angular dependence of x-ray absorption spectrum for field-aligned iron-based superconductors

Abstract: Anisotropic Fe K-edge and As K-edge X-ray absorption near edge spectrum (XANES) measurements on superconducting (Tc = 52 K) (Sm0.95La0.05)FeAs(O0.85F0.15) field-aligned microcrystalline powder are presented. The angular dependence of Fe pre-edge peak (dipole transition of Fe-1s electrons to Fe-3d/As-4p hybrid bands) relative to the tetragonal ab-plane of aligned powder indicates larger density of state (DOS) along the c-axis, and is consistent with the LDA band structure calculation. The anisotropic Fe K-edge … Show more

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Cited by 22 publications
(24 citation statements)
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“…The prepeak feature A (∼ 7112 eV) is the result of a direct quadrupole transition to unoccupied 3d states that are hybridized with Te 4p orbitals. The edge feature B (∼ 7118 eV) is governed by 1s → 4p transition, which is close to the one for a reference Fe 2+ standard, 33,34 indicating the Fe 2+ state. The peak-like feature C (∼ 7120 eV) should be driven by the 1s → 4p states admixed with Te d states, and the feature D is mainly due to multiple scattering of the photoelectrons with the nearest neighbors.…”
Section: Resultssupporting
confidence: 72%
“…The prepeak feature A (∼ 7112 eV) is the result of a direct quadrupole transition to unoccupied 3d states that are hybridized with Te 4p orbitals. The edge feature B (∼ 7118 eV) is governed by 1s → 4p transition, which is close to the one for a reference Fe 2+ standard, 33,34 indicating the Fe 2+ state. The peak-like feature C (∼ 7120 eV) should be driven by the 1s → 4p states admixed with Te d states, and the feature D is mainly due to multiple scattering of the photoelectrons with the nearest neighbors.…”
Section: Resultssupporting
confidence: 72%
“…Based on polarized Fe K-edge x-ray absorption of FeSe x crystals, pre-edge peak A and feature B show a larger density of states of corresponding to unoccupied Fe 3d-Se 4p and Fe 4p-Se 4d hybrid bands, respectively, along the c axis. 33,34 The larger compression along the c axis, accompanied by an increased FeSe 4 tetrahedral distortion of Fe 1.01 Se upon pressurization, suppresses the Fe 3d-Se 4p and Fe 4p-Se 4d hybridization, particularly along the c axis, and consequently leads to a decreased intensity of pre-edge peak A and feature B. 35 T c of Fe 1.01 Se increased to 34-37 K on applying P 5.5-9 GPa and then slowly decreased under P from 10 to 22 GPa.…”
Section: Resultsmentioning
confidence: 99%
“…A possible explanation is that this modulation for the K-doped samples might be ascribed to differences in the dd-interactions between the two types of hole-doping. [23][24][25][26]30,31]. In the supplemental material we include calculations of our HERFD-XANES spectra showing that the A peak has mostly dipole character and that it arises when the four As nearest neighbours conforming the FeAs 4 tetrahedra are included in the structure, which corroborates its origin in the Fe 3d -As 4p mixing.…”
mentioning
confidence: 89%