Effects of Self-Assembled Monolayer Modification of Nickel Oxide Nanoparticles Layer on the Performance and Application of Inverted Perovskite Solar Cells

Entirely low-temperature solution-processed (≤100 °C) planar p-i-n perovskite solar cells (PSCs) offer great potential for commercialization of roll-to-roll fabricated photovoltaic devices. However, the stable inorganic hole-transporting layer (HTL) in PSCs is usually processed at high temperature (200–500 °C), which is far beyond the tolerant temperature (≤150 °C) of roll-to-roll fabrication. In this context, inorganic NiO_x nanoparticles (NPs) are an excellent candidate to serve as the HTL in PSCs, owing to their excellent solution processability at room temperature. However, the low-temperature processing condition is usually accompanied with defect formation, which deteriorates the film quality and device efficiency to a large extent. To suppress this setback, we used a series of benzoic acid selfassembled monolayers (SAMs) to passivate the surface defects of the NiO_x NPs and found that 4-bromobenzoic acid could effectively play the role of the surface passivation. This SAM layer reduces the trap-assisted recombination, minimizes the energy offset between the NiO_x NPs and perovskite, and changes the HTL surface wettability, thus enhancing the perovskite crystallization, resulting in more stable PSCs with enhanced power conversion efficiency (PCE) of 18.4 %, exceeding the control device PCE (15.5 %). Also, we incorporated the above-mentioned SAMs into flexible PSCs (F-PSCs) and achieved one of the highest PCE of 16.2 % on a polyethylene terephthalate (PET) substrate with a remarkable power-per-weight of 26.9 W g⁻¹. This facile interfacial engineering method offers great potential for the large-scale manufacturing and commercialization of PSCs.