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Static and Dynamic Disorder in Formamidinium Lead Bromide Single Crystals

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https://figshare.com/articles/dataset/Static_and_Dynamic_Disorder_in_Formamidinium_Lead_Bromide_Single_Crystals/21988449
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We show that formamidinium-based crystals are distinct from methylammonium-based halide perovskite crystals because their inorganic sublattice exhibits intrinsic local static disorder that coexists with a well-defined average crystal structure. Our study combines terahertz-range Raman scattering with single-crystal X-ray diffraction and first-principles calculations to probe the evolution of inorganic sublattice dynamics with temperature in the range of 10–300 K. The temperature evolution of the Raman spectra shows that low-temperature, local static disorder strongly affects the crystal structural dynamics and phase transitions at higher temperatures.
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2023-02-01
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