Reliability of 3D Cs2M+M3+X6 type absorbers for perovskite solar cells: assessing the figures of merit

Altaf Pasha, Akhil S and R. Geetha Balakrishna

J. Mater. Chem. A, 2021, 9, 17701
DOI: 10.1039/D1TA04374A

Exploring the elastic, optoelectronic, and thermoelectric properties of a lead-free double perovskite KBaTeBiO6 via first-principles methods

Hansraj Karwasara, Aparna Dixit, Jisha Annie Abraham, Mumtaz Manzoor, Ramesh Sharma, Ekta Jain and Amit Soni

Multiscale and Multidiscip. Model. Exp. and Des., 2026, 9
DOI: 10.1007/s41939-025-01122-5

Designing and unlocking the potential of double perovskites X2NaVCl6 (X = Rb, K) for green energy applications

Sana Ullah Asif, Muhammad Qasim, Ahmad M. Saeedi, Raed H. Althomali, Majed M. Alghamdi, Adel A. El-Zahhar, Muhammad Zain Ul Abdin, Syed Zuhair Abbas Shah, Saima Zafar and Gideon F. B. Solre

Int. J. Mod. Phys. B, 2026, 40
DOI: 10.1142/S0217979226500797

Influence of heavy Hf doping in CeO2: Prediction on various physical properties

Khandaker Monower Hossain, Sujon Kumar Mitro, Samina Afrin Moon, M. Mozahar Ali, Sumal Chandra and M. Anwar Hossain

Results in Physics, 2022, 37, 105569
DOI: 10.1016/j.rinp.2022.105569

Design of In³⁺-Doped Cs₂AgBiCl₆ Lead-Free Halide Double Perovskite with Efficient Visible Absorption

Xinyu Zhao, Jing Luo, Huiying Sun, Chunbo Liu and Huaqiao Tan

Korean J. Chem. Eng., 2026, 43, 767
DOI: 10.1007/s11814-025-00602-1

Exploring the structural, phononic, electronic, magnetic, optical, and thermoelectric properties of Pb-free vanadium-based double perovskites using the first-principles approach for optoelectronic and thermoelectric applications

Syed Zuhair Abbas Shah, Shanawer Niaz, Tabassum Nasir and Shahid M. Ramay

Solar Energy, 2022, 240, 27
DOI: 10.1016/j.solener.2022.05.021

Structural stability, mechanical, and optoelectronic properties of A2TlBiI6 (A = Cs and Rb) for energy harvesting: A first principles investigation

Anwar ul Haq, Sadia Sagar Iqbal, Afaq Ahmad, Tasawer Shahzad Ahmad, Abu Bakar and Shahid M. Ramay

Journal of Physics and Chemistry of Solids, 2023, 176, 111225
DOI: 10.1016/j.jpcs.2023.111225

Recent progress of lead-free halide double perovskites for green energy and other applications

Mukaddar Sk

Appl. Phys. A, 2022, 128
DOI: 10.1007/s00339-022-05596-9

Computational discovery of layered Sc-based MOenes (Sc2OX2, X = Cl, Br, I): Insights into the electronic and thermal transport properties

Gautam Sharma, Abhishek Sharan and Nirpendra Singh

Computational Materials Science, 2026, 261, 114304
DOI: 10.1016/j.commatsci.2025.114304