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Euvrard, Julie; Wang, Xiaoming; Li, Tianyang; Yan, Yanfa; Mitzi, David B. (, Journal of Materials Chemistry A)In a quest for Pb-free perovskites suitable for solar energy applications, Cs 2 TiBr 6 has recently been reported as a promising compound, with appropriate optical and electrical properties as well as high stability under environmental stresses. In this study, we pursue investigation on this compound, demonstrating phase pure Cs 2 TiBr 6 powder formation using solution synthesis and providing complementary experimental characterization and theoretical calculations. An experimental absorption onset of around 2.0 eV is extracted and a weak broad photoluminescence is measured. Density functional theory calculations predict an indirect bandgap, parity-forbidden for both the direct and indirect transitions, which explains the weak and Stokes shifted luminescence. Additionally, we highlight the strong instability of Cs 2 TiBr 6 powder in ambient atmosphere. Therefore, our experimental results supported by theoretical calculations differ from previous results and raise doubts on the suitability of Cs 2 TiBr 6 in its pristine form for solar energy applications.more » « less
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Li, Chen; Ma, Hao; Li, Tianyang; Dai, Jinghang; Rasel, Md. Abu; Mattoni, Alessandro; Alatas, Ahmet; Thomas, Malcolm G.; Rouse, Zachary W.; Shragai, Avi; et al (, Nano Letters)
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Han, Qiwei; Ding, Jie; Bai, Yusong; Li, Tianyang; Ma, Jing-Yuan; Chen, Yao-Xuan; Zhou, Yihao; Liu, Jie; Ge, Qian-Qing; Chen, Jie; et al (, Chem)
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Abreu, Pedro; Albert, Andrea; Alfaro, Ruben Jose; Alfonso, Alexander; Alvarez, César; An, Qi; Angüner, Ekrem Oguzhan; Arcaro, Cornelia; Arceo, Roberto; Arias, Sandro; et al (, Pos proceedings of science)
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