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cond-mat.mtrl-sci2024
Modulation of electronic and piezoelectric properties of lead-free halide perovskites LiSnX (X = Cl, Br, and I) under applied pressure
Celestine Lalengmawia, R. Zosiamliana, Bernard Lalroliana +7
Pb-based perovskites are considered to be the most efficient materials for energy harvest. However, real-time application is limited because of their toxicity. As a result, lead-fr…
cond-mat.mtrl-sci2024
A comprehensive study of electronic and piezoelectric properties of Li-based Tin-halide perovskites from GGA and Meta-GGA
Celestine Lalengmawia, Zosiamliana Renthlei, Shivraj Gurung +7
Wide bandgap semiconductors (WBGs) are predicted to be the potential materials for energy generation and storing. In this work, we used density functional theory (DFT) that incorpo…