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Reversible Phase Transition for Durable Formamidinium-Dominated Perovskite Photovoltaics.

Huifen LiuNengxu LiZehua ChenShuxia TaoChunlei LiLang JiangXiuxiu NiuQi ChenFeng WangYu ZhangZijian HuangTinglu SongHuanping Zhou
Published in: Advanced materials (Deerfield Beach, Fla.) (2022)
Phase instability is one of the major obstacles to the wide application of formamidinium (FA)-dominated perovskite solar cells (PSCs). An in-depth investigation on relevant phase transitions is urgently needed to explore more effective phase-stabilization strategies. Herein, the reversible phase-transition process of FA 1- x Cs x PbI 3 perovskite between photoactive phase (α phase) and non-photoactive phase (δ phase) under humidity, as well as the reversible healing of degraded devices, is monitored. Moreover, through in situ atomic force microscopy, the kinetic transition between α and δ phase is revealed to be the "nucleation-growth transition" process. Density functional theory calculation implies an enthalpy-driven α-to-δ degradation process during humidity aging and an entropy-driven δ-to-α healing process at high temperatures. The α phase of FA 1- x Cs x PbI 3 can be stabilized at elevated temperature under high humidity due to the increased nucleation barrier, and the resulting non-encapsulated PSCs retain >90% of their initial efficiency after >1000 h at 60 °C and 60% relative humidity. This finding provides a deepened understanding on the phase-transition process of FA 1- x Cs x PbI 3 from both thermodynamics and kinetics points of view, which also presents an effective means to stabilize the α phase of FA-dominated perovskites and devices for practical applications.
Keyphrases
  • density functional theory
  • atomic force microscopy
  • high resolution
  • high speed
  • solar cells
  • high temperature