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Register a new userElement-Specific Phonon Density of States of Iron in LaFeAsO_{1-x}F_{x} and La_{1-x}Ca_{x}FePO
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Satoshi Higashitaniguchi
Publication date
2008
fields
Physics
and research's language is
English
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We have measured element-specific Fe-phonon densities of states (Fe-PDOS) of LaFeAsO_{1-x}F_{x} (x = 0, 0.11) and La_{1-x}Ca_{x}FePO (x = 0.13) by using nuclear resonant inelastic scattering of synchrotron radiation. The Fe-PDOS of superconductor LaFeAsO_{0.89}F_{0.11} (Tc = 26 K) and that of non-superconductor LaFeAsO have similar structures to both below Tc (15 K) and above Tc (298 K) and, therefore, fluorine doping does not have notable effect on the Fe-PDOS. As for the superconductor La_{0.87}Ca_{0.13}FePO (Tc = 5.4K), the entire structure of Fe-PDOS resembles with that of LaFeAsO_{1-x}F_{x}, but the energy of the highest peak is higher than that of LaFeAsO_{1-x}F_{x}. These peaks are attributed to vibrational modes between Fe and pnicogen (As and P) and the temperature-dependent energy shifts are observed for LaFeAsO_{1-x}F_{x}. Observed Fe-PDOS of LaFeAsO_{1-x}F_{x} agrees well with an previously calculated Fe-PDOS spectrum with a first-principles calculation and shows the structural resemblance with an calculated Eliashberg function #alpha^2F(x) giving small electron-phonon coupling. Therefore, our results indicate that phonons are not the main contributors to the Tc superconductivity of LaFeAsO_{1-x}F_{x}. From the experimental viewpoint, comparison of our observed Fe-PDOS and an experimentally obtained bosonic glue spectrum will be an important clue as to whether phonons are the main contributors to superconductivity in iron-pnictide superconductors.
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The lattice dynamics of LaFeAsO_{1-x}F_{x} (x=0, 0.1) and PrFeAsO_{1-y} (y~0.1) are investigated using inelastic x-ray scattering and ab-initio calculation. Measurements of powder samples provide an approximation to the phonon DOS, while dispersion is measured from a single crystal of PrFeAsO_{1-y}. A model that agrees reasonably well with all of the data at room temperature is built from results of ab-initio calculations by softening the strength of the Fe-As bond by 30%.
We report measurements of the phonon density-of-states in iron oxypnictide superconductors by inelastic x-ray scattering. A good agreement with ab-initio calculations that do not take into account strong electronic correlations is found, and an unpredicted softening of phonon branches under F doping of these compounds is observed. Raman scattering experiments lead us to conclude that this softening is not related to zone center phonons, and consequently imply an important softening of the relevant phonon branches at finite momentum transfer Q.
The {57}Fe-specific phonon density of states of Ba(Fe(1-x)Co(x))2As2 single crystals (x=0.0, 0.08) was measured at cryogenic temperatures and at high pressures with nuclear-resonant inelastic x-ray scattering. Measurements were conducted for two different orientations of the single crystals, yielding the orientation-projected {57}Fe-phonon density of states (DOS) for phonon polarizations in-plane and out-of-plane with respect to the basal plane of the crystal structure. In the tetragonal phase at 300 K, a clear stiffening was observed upon doping with Co. Increasing pressure to 4 GPa caused a marked increase of phonon frequencies, with the doped material still stiffer than the parent compound. Upon cooling, both the doped and undoped samples showed a stiffening, and the parent compound exhibited a discontinuity across the magnetic and structural phase transition. These findings are generally compatible with the changes in volume of the system upon doping, increasing pressure, or increasing temperature, but an extra softening of high-energy modes occurs with increasing temperature. First-principles computations of the phonon DOS were performed and showed an overall agreement with the experimental results, but underestimate the Grueneisen parameter. This discrepancy is explained in terms of a magnetic Grueneisen parameter, causing an extra phonon stiffening as magnetism is suppressed under pressure.
Nuclear magnetic resonance (NMR) measurements of an iron (Fe)-based superconductor LaFeAsO_{1-x}F_x (x = 0.08 and 0.14) were performed at ambient pressure and under pressure. The relaxation rate 1/T_1 for the overdoped samples (x = 0.14) shows T-linear behavior just above T_c, and pressure application enhances 1/T_1T similar to the behavior of T_c. This implies that 1/T_1T = constant originates from the Korringa relation, and an increase in the density of states at the Fermi energy D(E_F) leads to the enhancement of T_c. In the underdoped samples (x = 0.08), 1/T_1T measured at ambient pressure also shows T-independent behavior in a wide temperature range above T_c. However, it shows Curie-Weiss-like T dependence at 3.0 GPa accompanied by a small increase in T_c, suggesting that predominant antiferromagnetic fluctuation suppresses development of superconductivity or remarkable enhancement of T_c. The qualitatively different features between underdoped and overdoped samples are systematically explained by a band calculation with hole and electron pockets.
We investigated the temperature dependence of the density-of-states in the iron-based superconductor SmO_1-xF_xFeAs (x=0, 0.12, 0.15, 0.2) with high resolution angle-integrated photoemission spectroscopy. The density-of-states suppression is observed with decreasing temperature in all samples, revealing two characteristic energy scales (10meV and 80meV). However, no obvious doping dependence is observed. We argue that the 10meV suppression is due to an anomalously doping-independent normal state pseudogap, which becomes the superconducting gap once in the superconducting state; and alert the possibility that the 80meV-scale suppression might be an artifact of the polycrystalline samples.
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