The optical phonon spectrum of SmFeAsO

We measured the Raman and the Infrared phonon spectrum of SmFeAsO polycrystalline samples. We also performed Density Functional Theory calculations within the pseudopotential approximation to obtain the structural and dynamical lattice properties of both the SmFeAsO and the prototype LaFeAsO compoun...

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Published in:arXiv.org 2008-10
Main Authors: Marini, C, Mirri, C, Profeta, G, Lupi, S, D Di Castro, Sopracase, R, Postorino, P, Calvani, P, Perucchi, A, Massidda, S, Tropeano, G M, Putti, M, Martinelli, A, Palenzona, A, Dore, P
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Language:English
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Density functional theory
Infrared radiation
Phonons
Superconductivity
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creator Marini, C
Mirri, C
Profeta, G
Lupi, S
D Di Castro
Sopracase, R
Postorino, P
Calvani, P
Perucchi, A
Massidda, S
Tropeano, G M
Putti, M
Martinelli, A
Palenzona, A
Dore, P
description We measured the Raman and the Infrared phonon spectrum of SmFeAsO polycrystalline samples. We also performed Density Functional Theory calculations within the pseudopotential approximation to obtain the structural and dynamical lattice properties of both the SmFeAsO and the prototype LaFeAsO compounds. The measured Raman and Infrared phonon frequencies are well predicted by the optical phonon frequencies computed at the Gamma point, showing the capability of the employed ab-initio methods to describe the dynamical properties of these materials. A comparison among the phonon frequencies of different oxypnictides suggests a possible role of the high frequency phonons in the pairing mechanism leading to superconductivity in these materials.
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subjects Density functional theory
Infrared radiation
Phonons
Superconductivity
title The optical phonon spectrum of SmFeAsO
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