Journal
ADVANCED MATERIALS
Volume 33, Issue 13, Pages -Publisher
WILEY-V C H VERLAG GMBH
DOI: 10.1002/adma.202007224
Keywords
metal halide perovskites; optoelectronic thin films; phase transitions; polycrystalline textures
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Funding
- Research Foundation-Flanders (FWO) [12Y7218N, V439819N, 12Y7221N, 1SC1319, 12T3519N]
- KU Leuven Industrial Research Fund [C3/19/046]
- Research Foundation-Flanders (FWO) through research projects (FWO) [G098319N, ZW15_09-GOH6316]
- Flemish government through long term structural funding Methusalem (CASAS2) [Meth/15/04]
- KU Leuven Research Fund [C14/15/053, C19/19/079, C14/19/079]
- Flemish government [iBOF-21-085]
- U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Materials Sciences and Engineering Division, under Physical Chemistry of Inorganic Nanostructures Program [DE-AC02-05-CH11231, KC3103]
- Ghent University
- FWO
- Flemish Government-department EWI
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Controlling grain orientations within polycrystalline all-inorganic halide perovskite solar cells can help increase conversion efficiencies toward their thermodynamic limits, but the forces governing texture formation are still unclear. This study used synchrotron X-ray diffraction to investigate the mesostructure formation in polycrystalline CsPbI2.85Br0.15 powders, revealing that tetragonal distortions trigger preferential crystallographic alignment within polycrystalline ensembles.
Controlling grain orientations within polycrystalline all-inorganic halide perovskite solar cells can help increase conversion efficiencies toward their thermodynamic limits; however, the forces governing texture formation are ambiguous. Using synchrotron X-ray diffraction, mesostructure formation within polycrystalline CsPbI2.85Br0.15 powders as they cool from a high-temperature cubic perovskite (alpha-phase) is reported. Tetragonal distortions (beta-phase) trigger preferential crystallographic alignment within polycrystalline ensembles, a feature that is suggested here to be coordinated across multiple neighboring grains via interfacial forces that select for certain lattice distortions over others. External anisotropy is then imposed on polycrystalline thin films of orthorhombic (gamma-phase) CsPbI3-xBrx perovskite via substrate clamping, revealing two fundamental uniaxial texture formations; i) I-rich films possess orthorhombic-like texture ( out-of-plane; and in-plane), while ii) Br-rich films form tetragonal-like texture ( out-of-plane; and in-plane). In contrast to relatively uninfluential factors like the choice of substrate, film thickness, and annealing temperature, Br incorporation modifies the gamma-CsPbI3-xBrx crystal structure by reducing the orthorhombic lattice distortion (making it more tetragonal-like) and governs the formation of the different, energetically favored textures within polycrystalline thin films.
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