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Summary

The study presents Th-2EPT, a novel self-assembled monolayer (SAM) for tin perovskite solar cells, achieving a power conversion efficiency (PCE) of 8.2% in DMSO-free devices. Th-2EPT demonstrates a short-circuit current density (Jsc) of 18.97 mA/cm² and an open-circuit voltage (Voc) of 0.63 V, outperforming MeO-2PACz and PEDOT. The ideality factor for Th-2EPT is 1.98, indicating reduced non-radiative recombination, while enhancing interface quality and stability of perovskite films (Stacchini2026 pages 13-14, Stacchini2026 pages 17-20).

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Original Abstract/Summary:
Self-assembled monolayers (SAMs) have revolutionized the fabrication of lead-based perovskite solar cells, but they remain underexplored in tin perovskite systems. PEDOT is the material of choice for hole-selective layers in tin perovskite solar cells (TPSCs), but presents challenges for both performance and stability. MeO-2PACz, the only SAM reported for Sn perovskites, enables device fabrication but consistently underperforms when compared to PEDOT. In this work, we identify that MeO-2PACz's limitations arise from excessively strong interactions with perovskite surface and poor lattice matching, leading to poor interface quality. To overcome these issues, we design, synthesize, and characterize a novel SAM-forming molecule called Th-2EPT. Th-2EPT optimizes coordination strength and improves lattice compatibility, contributing to the creation of a high-quality buried interface and dramatically suppressing non-radiative recombination. We used Density Functional Theory (DFT) to evaluate coordination strength and lattice compatibility, complemented by nanosecond-resolution optical characterization techniques to confirm significantly reduced interfacial recombination and enhanced carrier lifetimes in Th-2EPT-Perovskite films. With Th-2EPT, we demonstrated the first SAM-based tin perovskite solar cells to outperform PEDOT-based devices, delivering a record power conversion efficiency (PCE) of 8.2% with a DMSO-free solvent system.
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