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Density Functional Study of Tetraphenylporphyrin Long-Range Exciton Coupling
The performance of time-dependent density functional theory (TDDFT) for calculations of long-range exciton circular dichroism (CD) is investigated. Tetraphenylporphyrin (TPP) is used as a representative of a class of strongly absorbing chromophores for which exciton CD with chromophore separations o...
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| Principais autores: | , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
WILEY-VCH Verlag
2012
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3922448/ https://ncbi.nlm.nih.gov/pubmed/24551508 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/open.201200020 |
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