
Small, Journal Year: 2025, Volume and Issue: unknown
Published: April 22, 2025
Abstract Metal halide perovskite solar cells (PSC) have emerged as a promising candidate for next‐generation photovoltaic technologies, achieving remarkable power conversion efficiencies (PCE) in polycrystalline thin‐films. Nonetheless, their PCE and long‐term stability are often limited by high density of defects at interfaces grain boundaries. One effective strategy to mitigate these issues is forming 2D/3D heterojunction structure introducing surface‐passivating interfacial layer quasi‐2D Ruddlesden–Popper (RPP) with various functional ligand molecules. In this study, hydroxyl‐functionalized cyclohexyl ammonium hydrochloride (ACHACl) employed the molecule, which features dual groups. A comparative analysis reveals that cis‐ configurations ligands exhibit enhanced adsorption on [PbI 6 ] 4− octahedra lead perovskites, enabling more passivation including metallic Pb 0 3D Moreover, incorporating RPP improves hole extraction transport (HTL) inducing an upward shift valence band edge. Consequently, PSCs achieve 23% under 1‐Sun illumination, along significantly improved stability, presenting critical role tailoring atomic molecules boost both efficiency PSCs.
Language: Английский