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First principles calculations are used to investigate the band structure andthe transport related properties of unfilled and filled 4d skutteruditeantimonides. The calculations show that, while RhSb3 and p-type La(Rh,Ru)4Sb12are unfavorable for thermoelectric application, n-type La(Rh,Ru)4Sb12 is verylikely a high figure of merit thermoelectric material in the importanttemperature range 150-300 K.Comment: 3 pages, 3 figures. To appear, Appl. Phys. Let

Prediction of room-temperature high-thermoelectric performance in n -type La(Ru1−xRhx)4Sb12