Ba-induced phase segregation and band gap reduction in mixed-halide inorganic perovskite solar cells.

Xiang, Wanchun; Wang, Zaiwei; Kubicki, Dominik J; Wang, Xueting; Tress, Wolfgang; Luo, Jingshan; Zhang, Jiahuan; Hofstetter, Albert et al. · Nat Commun · 2019

basic_science · Level V

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Abstract

All-inorganic metal halide perovskites are showing promising development towards efficient long-term stable materials and solar cells. Element doping, especially on the lead site, has been proved to be a useful strategy to obtain the desired film quality and material phase for high efficient and stable inorganic perovskite solar cells. Here we demonstrate a function by adding barium in CsPbI<sub>2</sub>Br. We find that barium is not incorporated into the perovskite lattice but induces phase segregation, resulting in a change in the iodide/bromide ratio compared with the precursor stoichiometry and consequently a reduction in the band gap energy of the perovskite phase. The device with 20 mol% barium shows a high power conversion efficiency of 14.0% and a great suppression of non-radiative recombination within the inorganic perovskite, yielding a high open-circuit voltage of 1.33 V and an external quantum efficiency of electroluminescence of 10<sup>-4</sup>.