## Abstract Using timeโdependent density functional theory and the polarizable continuum model, we have simulated the absorption spectra of an extended series of azobenzene dyes. First, we have determined a theoretical level optimal for this important class of dyes, and it turned out that a CโPCMโC
UV/Visible spectra of natural polyphenols: A time-dependent density functional theory study
โ Scribed by El Hassane Anouar; Johannes Gierschner; Jean-Luc Duroux; Patrick Trouillas
- Book ID
- 113626090
- Publisher
- Elsevier Science
- Year
- 2012
- Tongue
- English
- Weight
- 777 KB
- Volume
- 131
- Category
- Article
- ISSN
- 0308-8146
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