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- W4353045549 abstract "Abstract The stability of mixed-halide perovskite CsPb(I x Br 1-x ) 3 against the composition separation is studied by the first-principles calculations in the presence of photo-generated carriers. It is shown that, in the case without carriers, the mixed phase is stable around room temperature owing to the mixing-entropy effect of halide atoms. When such mixed phase is irradiated under the light and carriers are generated, on the other hand, the composition-separated phase becomes stable. We showed that the confinement of hole carriers in I-rich regions lowers the system energy and promotes the composition separation." @default.
- W4353045549 created "2023-03-23" @default.
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- W4353045549 date "2023-03-22" @default.
- W4353045549 modified "2023-09-24" @default.
- W4353045549 title "Photo-carrier induced composition separation in mixed-halide CsPb(I<sub>x</sub>Br<sub>1-x</sub>)<sub>3</sub> perovskite semiconductors; first-principles calculation" @default.
- W4353045549 doi "https://doi.org/10.35848/1882-0786/acc6b3" @default.
- W4353045549 hasPublicationYear "2023" @default.
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