2 papers
cond-mat.mtrl-sci2025
Group-I lead oxide XPbO (X=Li, Na, K, Rb, and Cs) glass-like materials for energy applications: A hybrid-DFT study
R. Zosiamliana, Lalhriat Zuala, Lalrinthara Pachuau +4
Pb-based compounds have garnered considerable theoretical and experimental attention due to their promising potential in energy-related applications. In this study, we explore the…
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…