Spatial Electron-hole Separation in a One Dimensional Hybrid Organic-Inorganic Lead Iodide.
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Peer-reviewed
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Authors
Savory, Christopher N
Palgrave, Robert G
Bronstein, Hugo https://orcid.org/0000-0003-0293-8775
Scanlon, David O
Abstract
The increasing efficiency of the inorganic-organic hybrid halides has revolutionised photovoltaic research. Despite this rapid progress, the significant issues of poor stability and toxicity have yet to be suitably overcome. In this article, we use Density Functional Theory to examine (Pb2I6) · (H2DPNDI) · (H2O) · (NMP), an alternative lead-based hybrid inorganic-organic solar absorber based on a photoactive organic cation. Our results demonstrate that optical properties suitable for photovoltaic applications, in addition to spatial electron-hole separation, are possible but efficient charge transport may be a limiting factor.
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Keywords
0303 Macromolecular and Materials Chemistry
Journal Title
Sci Rep
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Journal ISSN
2045-2322
2045-2322
2045-2322
Volume Title
6
Publisher
Springer Science and Business Media LLC
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Sponsorship
Engineering and Physical Sciences Research Council (EP/J017361/1)