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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Detalles Bibliográficos
Autores principales: Moore, Barry, Autschbach, Jochen
Formato: Online Artículo Texto
Lenguaje:English
Publicado: WILEY-VCH Verlag 2012
Materias:
Full Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3922448/
https://www.ncbi.nlm.nih.gov/pubmed/24551508
http://dx.doi.org/10.1002/open.201200020

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3922448/
https://www.ncbi.nlm.nih.gov/pubmed/24551508
http://dx.doi.org/10.1002/open.201200020

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