Electronic Structure and Thermoelectric Properties of Ytterbium-Filled Skuttcrudites

摘要

The electronic structure and thermoelectric properties of Yb partially filled CoSb_3 skutteru-dite compounds have been investigated by x-ray photoelectron spectroscopy and band calculation in terms of an itinerant felectron model. In these materials, the significant effect of Yb tilling is the large reduction of lattice thermal conductivity, remaining relatively high electron mobility and Seebeck coefficient, resulting in high thermoelectric figure of merit. We discuss the effects of the valence fluctuation between Yb~(2+) and Yb~(3+) and the strong hybridization of Yb 4f states with the valence band states on the electronic properties and their relation to thermoelectric properties for Yb partially filled CoSb_3 compounds.