Cargando…

Appealing perspectives of the structural, electronic, elastic and optical properties of LiRCl(3) (R = Be and Mg) halide perovskites: a DFT study

To enhance the effectiveness of materials, we are motivated to investigate lithium-based halide perovskites LiRCl(3) (where R = Be and Mg) using first-principles techniques based on density functional theory (DFT), implemented in the WIEN2K code. In this study, the research makes use of the WIEN2K s...

Descripción completa

Detalles Bibliográficos
Autores principales: Rahman, Nasir, Husain, Mudasser, Tirth, Vineeth, Algahtani, Ali, Alqahtani, Hassan, Al-Mughanam, Tawfiq, Alghtani, Abdulaziz H., Khan, Rajwali, Sohail, Mohammad, Khan, Abid Ali, Azzouz-Rached, Ahmed, Khan, Aurangzeb
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10284150/
https://www.ncbi.nlm.nih.gov/pubmed/37350857
http://dx.doi.org/10.1039/d3ra02640j