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Efficiency optimization of lead-free CH3NH3SnI3-based perovskite solar cells through material and structural modifications

Qana A. Alsulami, Rasul Al Foysal Redoy, S. Wageh

2025Scientific Reports12 citationsDOIOpen Access PDF

Abstract

This study focuses on optimizing the efficiency of lead-free perovskite solar cells (PSCs) using CH 3 NH 3 SnI 3 as the active layer. Various modifications were investigated to enhance the performance of the PSCs. Key adjustments included the choice of polymer as a hole-transporting material (HTM), electrode materials, device structure, and the incorporation of a thin layer of nickel oxide (NiO) as a hole-selective layer (HSL). The results demonstrate that replacing ZnTe with TAPC polymer as the HTM led to a significant increase in power conversion efficiency (PCE) due to better band alignment and electron-blocking properties. Additionally, substituting the expensive gold electrode with aluminum was facilitated by incorporating a PEDOT conductive polymer buffer layer to improve carrier extraction efficiency. Transitioning from a traditional n-i-p structure to a p-i-n inverted structure and optimizing TiO 2 placement further enhanced light absorption and device current. The introduction of a thin NiO layer, optimized at 5 nm thickness, contributed to improved PCE, short-circuit current density (J sc ), and open-circuit voltage (V oc ). Ultimately, the optimized PSC structure yielded an impressive PCE of 12.37%, indicating a substantial advancement in efficiency compared to previous studies. These findings underscore the potential of lead-free perovskite materials, particularly CH 3 NH 3 SnI 3 , in revolutionizing solar energy technology toward a more sustainable and efficient future.

Topics & Concepts

Lead (geology)Perovskite (structure)Materials scienceComputer scienceChemistryBiologyCrystallographyPaleontologyPerovskite Materials and ApplicationsChalcogenide Semiconductor Thin FilmsSolid-state spectroscopy and crystallography