Search for a Small Chromophore with Efficient Singlet Fission: Biradicaloid Heterocycles

2012-09-01
Akdağ, Akın
Michl, Josef
Of the five small biradicaloid heterocycles whose S-1, S-2, T-1, and T-2 adiabatic excitation energies were examined by the CASPT2/ANO-L-VTZP method, two have been found to meet the state energy criterion for efficient e singlet fission and are recommended to the attention of synthetic chemists and photophysicists.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

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Citation Formats
A. Akdağ and J. Michl, “Search for a Small Chromophore with Efficient Singlet Fission: Biradicaloid Heterocycles,” JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, pp. 14624–14631, 2012, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/57842.