Pressure induced quenching of planar rattling in CuZnSbS studied by specific-heat and x-ray diffraction measurements
arXiv:2009.05196 · doi:10.1103/PhysRevB.102.100302
Abstract
We have studied the pressure effect on the rattling of tetrahedrite CuZnSbS(CZSS) and type-I clathrate BaGaSn(BGS) by specific heat and x-ray diffraction measurements. By applying pressure , the rattling energy for CZSS initially decreases and steeply increases for $\textgreater$ GPa. By contrast, the energy for BGS increases monotonically with up to 6.5 GPa. An analysis of the pressure dependent specific heat and x-ray diffraction indicates that the out-of-plane rattling of the Cu atoms in the S triangle of CZSS originates from the chemical pressure, unlike the rattling of the Ba ions among off-center sites in an oversized cage of BGS. The rattling in CZSS ceases upon further increasing above 2 GPa, suggesting that Cu atoms escape away from the S triangle plane.
16 pages, 3 figures, 1 table