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The TDDFT Excitation Energies of the BODIPYs; The DFT and TDDFT Challenge Continues
The derivatives of 4,4-difluoro-4-bora-3a,4a-diaza-s-indacene (BODIPY) are pivotal ingredients for a large number of functional, stimuli-responsive materials and therapeutic molecules based on their photophysical properties, and there is a urgent need to understand and predict their optical traits p...
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| Publicado no: | Molecules |
|---|---|
| Main Authors: | , , , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
MDPI
2021
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC8005089/ https://ncbi.nlm.nih.gov/pubmed/33810021 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules26061780 |
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