Koerbel S, Marques MAL, Botti S (2018)
Publication Type: Journal article
Publication year: 2018
Book Volume: 6
Pages Range: 6463-6475
Journal Issue: 15
DOI: 10.1039/c7ta08992a
Hybrid perovskites, such as methylammonium lead iodide, have revolutionized research on solar cells in the past few years. Well known instability and toxicity issues restrain however the large-scale application of these perovskites in commercial photovoltaic technology. It is therefore the most urgent task to find a way to chemically stabilize these and other lead-free perovskites, preserving at the same time their excellent absorption and charge-transport properties. The obvious route to follow is chemical substitution. In this work we screen the periodic table of elements for hybrid organic-inorganic halide perovskites, using high-throughput density-functional theory calculations. We consider compounds with the composition A+B2+X
APA:
Koerbel, S., Marques, M.A.L., & Botti, S. (2018). Stable hybrid organic-inorganic halide perovskites for photovoltaics from: Ab initio high-throughput calculations. Journal of Materials Chemistry A, 6(15), 6463-6475. https://doi.org/10.1039/c7ta08992a
MLA:
Koerbel, Sabine, Miguel A. L. Marques, and Silvana Botti. "Stable hybrid organic-inorganic halide perovskites for photovoltaics from: Ab initio high-throughput calculations." Journal of Materials Chemistry A 6.15 (2018): 6463-6475.
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