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Ab initio study on the excited states of pyrene and its derivatives using multi-reference perturbation theory methods
Low-lying singlet excited states of pyrene derivatives originated from the (1)L(a) and (1)L(b) states of pyrene have decisive influences on their absorption and fluorescence emission behaviors. Calculation of these excited states with quantitative accuracy is required for the theoretical design of p...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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The Royal Society of Chemistry
2020
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9051409/ https://www.ncbi.nlm.nih.gov/pubmed/35492109 http://dx.doi.org/10.1039/c9ra10483f |