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Computational Simulation of Vibrationally-Resolved Spectra for Spin-Forbidden Transitions
In this computational study, we illustrate a method for computing phosphorescence and circularly polarized phosphorescence (CPP) spectra of molecular systems, which takes into accounts vibronic effects including both Franck-Condon and Herzberg-Teller contributions. The singlet and triplet states inv...
Gardado en:
| Publicado en: | Chirality |
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| Main Authors: | , , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
2018
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| Assuntos: | |
| Acceso en liña: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6003600/ https://ncbi.nlm.nih.gov/pubmed/29727500 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/chir.22864 |
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