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Lattice Dynamics of LaFeAsO_(1-x)F_(x) and PrFeAsO_(1-y) via Inelastic X-Ray Scattering and First-Principles Calculation

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arxiv 0808.0838 v2 pith:ZXJRUZZC submitted 2008-08-06 cond-mat.supr-con

Lattice Dynamics of LaFeAsO_(1-x)F_(x) and PrFeAsO_(1-y) via Inelastic X-Ray Scattering and First-Principles Calculation

classification cond-mat.supr-con
keywords prfeasoab-initiocalculationdynamicsinelasticlafeasolatticescattering
verification ladder T0 review T1 audit T2 compute T3 formal T4 reserved
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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%.

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