Authors : O. E. Otunuga; O. T. Uto; M. T. Raji; P. O. Adebambo; K. D Ajayi

Volume/Issue : Volume 11 - 2026, Issue 9 - September

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Google Scholar : https://tinyurl.com/27e8un77

DOI : https://doi.org/10.38124/ijisrt/26sep243

Note : A published paper may take 4-5 working days from the publication date to appear in PlumX Metrics, Semantic Scholar, and ResearchGate.

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Abstract : The density functional theory was used to investigate the structural, electronic, elastic, and thermoelectric properties of ZrNiSn, ZrPdSn, and ZrPtSn Half-Heusler (HH) alloys. For these three alloys, the minimum lattice constants were calculated to be 6.1672, 6.4614, and 6.4550 ˚A, respectively.

Keywords : Lattice Constant; Bandgap, Poisson Ratio; Anisotropic Factor; Ther-Moelectric Alloys; Power Factor; Seebeck Coefficient.

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