Band engineering of high performance p-type FeNbSb based half-Heusler thermoelectric materials for figure of merit zT > 1

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Abstract

High performance p-type half-Heusler compounds FeNb _1−xTi _xSb are developed via a band engineering approach and a record zT of 1.1 is achieved.

We report new p-type FeNb _1−xTi _xSb (0.04 ≤ x ≤ 0.24) half-Heusler thermoelectric materials with a maximum zT of 1.1 at 1100 K, which is twice that of the ZrCoSb half-Heusler alloys. The electrical properties are optimized by a tradeoff between the band effective mass and mobility via a band engineering approach. A high content of Ti up to x = 0.2 optimizes the power factor and reduces the lattice thermal conductivity. In view of abundantly available elements, good stability and high zT, FeNb _1−xTi _xSb alloys could be promising materials for high temperature power generation.

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Complex thermoelectric materials.

G Jeffrey Snyder, Eric Toberer (2008)

Thermoelectric materials, which can generate electricity from waste heat or be used as solid-state Peltier coolers, could play an important role in a global sustainable energy solution. Such a development is contingent on identifying materials with higher thermoelectric efficiency than available at present, which is a challenge owing to the conflicting combination of material traits that are required. Nevertheless, because of modern synthesis and characterization techniques, particularly for nanoscale materials, a new era of complex thermoelectric materials is approaching. We review recent advances in the field, highlighting the strategies used to improve the thermopower and reduce the thermal conductivity.

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Convergence of electronic bands for high performance bulk thermoelectrics.

Yanzhong Pei, Xiaoya Shi, Aaron D LaLonde … (2011)

Thermoelectric generators, which directly convert heat into electricity, have long been relegated to use in space-based or other niche applications, but are now being actively considered for a variety of practical waste heat recovery systems-such as the conversion of car exhaust heat into electricity. Although these devices can be very reliable and compact, the thermoelectric materials themselves are relatively inefficient: to facilitate widespread application, it will be desirable to identify or develop materials that have an intensive thermoelectric materials figure of merit, zT, above 1.5 (ref. 1). Many different concepts have been used in the search for new materials with high thermoelectric efficiency, such as the use of nanostructuring to reduce phonon thermal conductivity, which has led to the investigation of a variety of complex material systems. In this vein, it is well known that a high valley degeneracy (typically ≤6 for known thermoelectrics) in the electronic bands is conducive to high zT, and this in turn has stimulated attempts to engineer such degeneracy by adopting low-dimensional nanostructures. Here we demonstrate that it is possible to direct the convergence of many valleys in a bulk material by tuning the doping and composition. By this route, we achieve a convergence of at least 12 valleys in doped PbTe(1-x)Se(x) alloys, leading to an extraordinary zT value of 1.8 at about 850 kelvin. Band engineering to converge the valence (or conduction) bands to achieve high valley degeneracy should be a general strategy in the search for and improvement of bulk thermoelectric materials, because it simultaneously leads to a high Seebeck coefficient and high electrical conductivity. ©2011 Macmillan Publishers Limited. All rights reserved