Imaging the Ultrafast Photoelectron Transfer Process in Alizarin-TiO2
نویسندگان
چکیده
منابع مشابه
Imaging the Ultrafast Photoelectron Transfer Process in Alizarin-TiO2.
In this work, we adopt a quantum mechanical approach based on time-dependent density functional theory (TDDFT) to study the optical and electronic properties of alizarin supported on TiO2 nano-crystallites, as a prototypical dye-sensitized solar cell. To ensure proper alignment of the donor (alizarin) and acceptor (TiO2 nano-crystallite) levels, static optical excitation spectra are simulated u...
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ژورنال
عنوان ژورنال: Molecules
سال: 2015
ISSN: 1420-3049
DOI: 10.3390/molecules200813830