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Uncovering the Mechanism Behind the Improved Stability of 2D OrganicInorganic Hybrid Perovskites
Z.Shi; Z.Cao; X.Sun; Y.Jia; D.Li; L.Cavallo; U.Schwingenschlogl
2019
发表期刊Small
ISSN16136810
卷号15期号:16
摘要2D organicinorganic hybrid perovskites (OIHPs) may resolve the stability problem of bulk OIHPs. First-principles calculations are employed to investigate the mechanism behind their favorable material properties. Two processes are identified to play a critical role: First, the 2D structure supports additional distortions that enhance the intrinsic structural stability. Second, the surface terminations of 2D OIHPs suppress degradation effects due to humidity. Having uncovered the stabilization mechanism, 2D OIHPs are designed with optimal stability and favorable electronic properties. 2019 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim
关键词Stabilization,Calculations,Convergence of numerical methods,Electronic properties,Perovskite,Perovskite solar cells,Solar cells
DOI10.1002/smll.201900462
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收录类别SCI ; EI
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文献类型期刊论文
条目标识符http://ir.ciomp.ac.cn/handle/181722/63077
专题中国科学院长春光学精密机械与物理研究所
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Z.Shi,Z.Cao,X.Sun,et al. Uncovering the Mechanism Behind the Improved Stability of 2D OrganicInorganic Hybrid Perovskites[J]. Small,2019,15(16).
APA Z.Shi.,Z.Cao.,X.Sun.,Y.Jia.,D.Li.,...&U.Schwingenschlogl.(2019).Uncovering the Mechanism Behind the Improved Stability of 2D OrganicInorganic Hybrid Perovskites.Small,15(16).
MLA Z.Shi,et al."Uncovering the Mechanism Behind the Improved Stability of 2D OrganicInorganic Hybrid Perovskites".Small 15.16(2019).
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