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Surface–defect‐triggered non‐radiative charge recombination and poor stability have become the main roadblock to continued improvement in inorganic perovskite solar cells (PSCs). Herein, the main culprits are identified on the inorganic perovskite surface by first‐principles calculations, and to purposefully design a brand‐new passivator, Boc‐S‐4‐methoxy‐benzyl‐l‐cysteine (BMBC), whose multiple Lewis‐based...
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