Strain-tunable electronic structure, optical and thermoelectric properties of BAs
Heng Yu,
Yi Li,
Dong Wei
et al.
Abstract:Strain engineering stands as a reliable method for tailoring the physicochemical properties of materials to achieve desired performance. However, the effects of strain on the physicochemical properties of BAs remain unclear, impeding the comprehensive understanding of its practical performance. Here, employing first-principles calculations coupled with semiclassical Boltzmann transport theory, we investigate the dynamic stability, mechanical stability, electronic structure, and thermoelectric properties of cub… Show more
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