Probing the path for achieving a broad temperature plateau of the figure of merit in thermoelectric nanocomposite materials

Abstract

The efficiency of a thermoelectric device depends directly on the average figure of merit (zT) of the material. A high average zT requires a broad temperature plateau with a high zT, but state-of-the-art thermoelectric materials display a peaked zT over a narrow temperature range due to a strong temperature dependence of transport properties. In this work, using Boltzmann transport theory, we systematically investigate the underlying physics and propose a strategy for attaining a broad temperature plateau of zT through proper engineering of the interfacial barrier height in PbTe nanocomposite material. The optimized barrier height (UconstantzT) not only enhances the zT but also maintains its high value over a wide temperature range [Tmin:Tmax]. It has been found that for p = 2.8 × 1020 cm−3, the UconstantzT is 0.112 eV at which zT varies between 1.9–2.14 over a wide temperature range of 550–850 K, resulting in a high average zT of 2.02 in comparison to a bulk value of 1.22. Also, for p = 5 × 1019 cm−3, UconstantzT is 0.102 eV at which zT varies between 1.046–1.435 for a temperature range of 300–600K, resulting in a high average zT of 1.27 over a bulk value of 0.844. The above results show that the range [Tmin:Tmax] depends on carrier concentration which, in turn, determines the position of the Fermi level (Ef) and Fermi window at Tmin and Tmax. To obtain a broad temperature plateau of zT, the findings show that at Tmin, Ef should lie inside the band and zT should show strong variation with barrier height, whereas at Tmax, Ef should lie in the band gap and zT should have little variation with barrier height. This trend allows us to choose UconstantzT which synergistically optimizes the transport properties at Tmin with Tmax to give a broad temperature plateau of zT. This work proposes a new advantage of interfacial scattering which enhances the average zT and also provides necessary guidelines to experimentalists for synthesizing a highly efficient thermoelectric device.

Investigating the key role of carrier transport mechanism in SnSe nanoflakes with enhanced thermoelectric power factor

“…One of the prime reasons for this is an order of magnitude lower σ of Pnma-SnSe, and hence a reduced PF than Cmcm-SnSe. Thus, efforts are needed towards improving the TE properties of the Pnma-SnSe [27][28][29]. Alongside, scientists are striving for an alternative synthesis process of poly-crystalline SnSe, which can be used in the multi domain applications.…”