The DOI matches its Crossref record; 285 of the 285 references it cites were found in a registry or an index.
Theoretical Modeling of Singlet Fission
Abstract
Singlet fission is a photophysical reaction in which a singlet excited electronic state splits into two spin-triplet states. Singlet fission was discovered more than 50 years ago, but the interest in this process has gained a lot of momentum in the past decade due to its potential as a way to boost solar cell efficiencies. This review presents and discusses the most recent advances with respect to the theoretical and computational studies on the singlet fission phenomenon. The work revisits important aspects regarding electronic states involved in the process, the evaluation of fission rates and interstate couplings, the study of the excited state dynamics in singlet fission, and the advances in the design and characterization of singlet fission compounds and materials such as molecular dimers, polymers, or extended structures. Finally, the review tries to pinpoint some aspects that need further improvement and proposes future lines of research for theoretical and computational chemists and physicists in order to further push the understanding and applicability of singlet fission.
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Cites
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Cited by
Tay, N. E. S., Lehnherr, D., & Rovis, T. (2022) · Chemical Reviews · doi:10.1021/acs.chemrev.1c00384 · Cited by 518
Do Diradicals Behave Like Radicals?
Stuyver, T., Chen, B., Zeng, T., Geerlings, P., De Proft, F., & Hoffmann, R. (2019) · Chemical Reviews · doi:10.1021/acs.chemrev.9b00260 · Cited by 401
Fujii, K., Mizuta, K., Ueda, H., Mitarai, K., Mizukami, W., & Nakagawa, Y. O. (2020) · arXiv · doi:10.48550/arxiv.2007.10917 · Cited by 66
Metadata
- Authors
- Casanova, D.
- Venue
- Chemical Reviews
- Publisher
- American Chemical Society (ACS)
- Published
- 2018-04-12
- Volume
- 118
- Issue
- 15
- Pages
- 7164-7207
- ISSN
- 0009-2665 (ISSN-L)
- 1520-6890
- OpenAlex
- W2797333726
- Cited by
- 468
- References
- 285
- FWCI
- 2.59
- Type
- journal article
- Language
- en
- Open access
- closed
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