Moisture‐Resistant FAPbI3 Perovskite Solar Cell with 22.25 % Power Conversion Efficiency through Pentafluorobenzyl Phosphonic Acid Passivation

Abstract Perovskite solar cells (PSCs) have shown great promise for photovoltaic applications, owing to their low‐cost assembly, exceptional performance, and low‐temperature solution processing. However, the advancement of PSCs towards commercialization requires improvements in efficiency and long‐term stability. The surface and grain boundaries of perovskite layer, as well as interfaces, are critical factors in determining the performance of the assembled cells. Defects, which are mainly located at perovskite surfaces, can trigger hysteresis, carrier recombination, and degradation, which diminish the power conversion efficiencies (PCEs) of the resultant cells. This study concerns the stabilization of the α‐FAPbI 3 perovskite phase without negatively affecting the spectral features by using 2,3,4,5,6‐pentafluorobenzyl phosphonic acid (PFBPA) as a passivation agent. Accordingly, high‐quality PSCs are attained with an improved PCE of 22.25 % and respectable cell parameters compared to the pristine cells without the passivation layer. The thin PFBPA passivation layer effectively protects the perovskite layer from moisture, resulting in better long‐term stability for unsealed PSCs, which maintain >90 % of the original efficiency under different humidity levels (40–75 %) after 600 h. PFBPA passivation is found to have a considerable impact in obtaining high‐quality and stable FAPbI 3 films to benefit both the efficiency and the stability of PSCs.