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Updated: Jan 20, 2026
Phase Transitions and Effect of Intermolecular Forces
Size-Dependent Phase Transition in Perovskite Nanocrystals
Lige Liu1,2, Ru Zhao3,4, Changtao Xiao3
1State Key Laboratory for Mesoscopic Physics, Collaborative Innovation Center of Quantum Matter, School of Physics , Peking University , Beijing 100871 , China.
Nanoscale methylammonium lead bromide (CH3NH3PbBr3) perovskite crystals exhibit size-dependent phase transitions. Smaller 2 nm nanocrystals lack the cubic-to-tetragonal transition observed in 4 nm particles, impacting their photoluminescence properties.
Area of Science:
- Materials Science
- Condensed Matter Physics
- Nanotechnology
Background:
- Halide and oxide perovskites possess complex structures influencing their physical properties.
- Nanoscale dimensions can significantly alter material behavior compared to bulk.
- Understanding size-dependent properties is crucial for designing advanced perovskite materials.
Purpose of the Study:
- To investigate the effect of reduced dimensions on the phase transition behavior of methylammonium lead bromide (CH3NH3PbBr3) nanocrystals.
- To correlate photoluminescence properties with phase transitions in single perovskite nanocrystals.
- To elucidate the size-dependent influence on temperature-induced phase transitions.
Main Methods:
- Single-dot optical experiments, including spectral and temporal photoluminescence probing.
- Investigation of methylammonium lead bromide (CH3NH3PbBr3) nanocrystals with average sizes of ~2 nm and ~4 nm.
- Application of Landau theory for theoretical calculations of phase transitions.
Main Results:
- Abrupt blue shifts in photoluminescence spectra and lifetimes at ~150 K were observed in 4 nm nanocrystals, linked to a cubic-to-tetragonal phase transition.
- This phase transition was absent in the smaller 2 nm nanocrystals within the studied temperature range (5-295 K).
- Theoretical calculations confirmed a strong size-dependent effect on temperature-induced phase transitions in individual CH3NH3PbBr3 nanocrystals.
Conclusions:
- The cubic-to-tetragonal phase transition in methylammonium lead bromide (CH3NH3PbBr3) is suppressed in ultrasmall nanocrystals (< 4 nm).
- Size-dependent phase transition behavior significantly impacts the photoluminescence properties of perovskite nanocrystals.
- Structure-property relationships in ultrasmall perovskite crystals must account for these size-dependent effects.
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