Optoelectronic and thermoelectric properties of new lead-free K2NaSbZ6 (Z = Br, I) halide double-perovskites for clean energy applications: a DFT study

A Boutramine, S Al-Qaisi, S Samah, N Iram… - Optical and Quantum …, 2024 - Springer
In this study, the density functional theory (DFT) is employed to investigate the structural,
elastic, optoelectronic, and thermoelectric (TE) properties of K2NaSbZ6 (Z= Br, I) halide …

Insight into the physical properties of lead-free Chloroperovskites GaXCl3 (X = Be, Ca) compounds: probed by DFT

Z Khan, SN Khan, M Husain, N Rahman, V Tirth… - Optical and Quantum …, 2024 - Springer
This research employs the FP-LAPW approach within density functional theory to investigate
the structural, optical, electronic, and elastic features of GaXCl3 (X= Be, Ca) …

Exploring the structural, electronic and optical properties of Rb2InGaCl6 and Rb2InGaF6 double perovskite compounds for high-energy applications: a DFT-based …

SA Shah, M Husain, V Tirth, M Uzair, N Rahman… - Optical and Quantum …, 2024 - Springer
Double perovskites have harvested considerable attention in the realm of solar cells and
renewable energy applications. Therefore, in this current study, we explored the structural …