Heusler compounds are a large group of intermetallic compositions with versatile material
properties. In recent times, they are found to be important for their practical applications in …

This review is focused on state-of-the-art thermoelectric materials (or thermoelements), from
which the thermoelements with the highest figures of merit (z) along with the those having …

Like full or half-heusler materials, equiatomic quaternary Heuslers (EQH) also display
various intriguing physical properties. We carried out the strict and rigorous density …

In this paper, we have performed a comprehensive set of first-principles calculations to study
elastic, electronic, thermodynamic and thermoelectric properties of TaCoSn using density …

We hereby discuss the thermoelectric properties of PdXSn (X= Zr, Hf) half Heuslers in
relation to lattice thermal conductivity probed under effective mass (hole/electrons) …

To address growing global energy needs, half Heusler compounds offer a cost-effective and
efficient solution for power generation applications. We present a study on the structural …

Abstract Both Ti2FeGe and CoTiFeGe compounds were designed based on density
functional theory within GGA and mBJ-GGA approximations. Lattice parameter optimization …

Electronic structure with reference to bandgap energies play a significant role in deciding
the dimensionless figure of merit (ZT), which in turn is used to identify the thermoelectric …

In the present report, the electronic, mechanical, phonon and thermoelectric properties of
stable TaIrSn novel Half Heusler compound are being evaluated using density functional …

Deeper understanding of electrical and thermal transport is critical for further development of
thermoelectric materials. Here we describe the thermoelectric performance of a group of rare …