Abstract

The quasi-skutterudite superconductor La3_3Co4_4Sn13_{13} undergoes a phase transition at T∗=152T^*=152 K. By measuring the temperature dependence of heat capacity, electrical resistivity, and the superlattice reflection intensity using X-ray, we explore the character of the phase transition at T∗T^*. Our lattice dynamic calculations found imaginary phonon frequencies around the M{\bf M} point, when the high temperature structure is used in the calculations, indicating that the structure is unstable at the zero temperature limit. The combined experimental and computational results establish that T∗T^* is associated with a second-order structural transition with q\bf{q}=(0.5, 0.5, 0) (or the M{\bf M} point). Further electronic bandstructure calculations reveal Fermi surface sheets with low curvature segments, which allow us to draw qualitative comparison with both Sr3_3Ir4_4Sn13_{13} and Sr3_3Rh4_4Sn13_{13} in which similar physics has been discussed recently.

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