Vacancy-induced dislocations within grains for high-performance PbSe thermoelectrics.

Chen, Zhiwei; Ge, Binghui; Li, Wen; Lin, Siqi; Shen, Jiawen; Chang, Yunjie; Hanus, Riley; Snyder, G Jeffrey et al. · Nat Commun · 2017

basic_science · Level V

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Abstract

To minimize the lattice thermal conductivity in thermoelectrics, strategies typically focus on the scattering of low-frequency phonons by interfaces and high-frequency phonons by point defects. In addition, scattering of mid-frequency phonons by dense dislocations, localized at the grain boundaries, has been shown to reduce the lattice thermal conductivity and improve the thermoelectric performance. Here we propose a vacancy engineering strategy to create dense dislocations in the grains. In Pb<sub>1-x</sub>Sb<sub>2x/3</sub>Se solid solutions, cation vacancies are intentionally introduced, where after thermal annealing the vacancies can annihilate through a number of mechanisms creating the desired dislocations homogeneously distributed within the grains. This leads to a lattice thermal conductivity as low as 0.4 Wm<sup>-1</sup> K<sup>-1</sup> and a high thermoelectric figure of merit, which can be explained by a dislocation scattering model. The vacancy engineering strategy used here should be equally applicable for solid solution thermoelectrics and provides a strategy for improving zT.