Charge Density Wave Instability and Soft Phonon in AAPt3_3P (AA=Ca, Sr, and La)

preprint2012arXivOpen access

Abstract

The electronic and phonon properties of the platinum pnictide superconductors AAPt3_3P (AA=Ca, Sr, and La) were studied using first-principles calculations. The spin-orbit coupling effect is significant in LaPt3_3P but negligible in CaPt3_3P and SrPt3_3P, although they all share the same anti-pevroskite structure. Moreover, SrPt3_3P has been demonstrated to exhibit an unexpected weak charge-density-wave(CDW) instability which is neither simply related to the Fermi-surface nesting nor to the momentum-dependent electron-phonon coupling alone. The instability is absent in CaPt3_3P and can be quickly suppressed by the external pressure, accompanied with gradual decreases in the phonon softening and BCS TcT_c. Our results suggest SrPt3_3P as a rare example where superconductivity is enhanced by the CDW fluctuations.

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