paper

Phonon anomalies and lattice dynamics in superconducting oxychlorides CaCuOCl

arXiv:1305.6719 · doi:10.1103/PhysRevB.88.014522

Abstract

We present a comprehensive study of the phonon dispersion in an underdoped, superconducting CaCuOCl crystal. We interpret the results using lattice dynamical calculations based on a shell model, and we compare the results, to other hole-doped cuprates, in particular to the ones isomorphic to LaSrCuO (LSCO). We found that an anomalous dip in the Cu-O bond stretching dispersion develops in oxychlorides with a simultaneous marked broadening of the mode. The broadening is maximum at that corresponds to the charge-modulations propagation vector. Our analysis also suggests that screening effects in calculations may cause an apparent cosine-shaped bending of the Cu-O bond-stretching dispersion along both the ( 0 0) and ( 0) directions, that is not observed on the data close to optimal doping. This observation suggests that the discrepancy between experimental data and \textit{ab-initio} calculations on this mode originates from an overestimation of the doping effects on the mode.

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