Investigation on the electronic structure, optical, elastic, mechanical, thermodynamic and thermoelectric properties of wide band gap semiconductor double perovskite Ba<sub>2</sub>InTaO<sub>6</sub>
Sajad Ahmad DarRamesh SharmaDepartment of Applied ScienceVipul SrivastavaDepartment of PhysicsUmesh Kumar SakalleBHEL
2019en
ABI
Abstract
In the present paper, double perovskite Ba<sub>2</sub>InTaO<sub>6</sub> was investigated in terms of its structural, electronic, optical, elastic, mechanical, thermodynamic and thermoelectric properties using density-functional theory (DFT).
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