Appealing perspectives of the structural, electronic, elastic and optical properties of LiRCl<sub>3</sub> (R = Be and Mg) halide perovskites: a DFT study
Nasir Rahman, Mudasser Husain, Vineet Tirth, Ali Algahtani, Hassan Alqahtani, Tawfiq Al‐Mughanam, Abdulaziz H. Alghtani, Rajwali Khan, Mohammad Sohail, Abid Ali Khan, Ahmed Azzouz‐Rached, Aurangzeb Khan
Abstract
are brittle in nature. These materials appear to be potential candidates for use in optoelectronic devices based on our analysis of their optical properties. Our findings may provide comprehensive insight, invoking experimental studies for further investigations.
Topics & Concepts
HalideMaterials scienceCrystallographyChemistryComputational chemistryInorganic chemistryPerovskite Materials and ApplicationsSolid-state spectroscopy and crystallographyLuminescence Properties of Advanced Materials