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Photophysics and Photochemistry of a BODIPY-Based Photosensitizer
- Quantumchemical Simulations
Engelsk
Bogcover for Photophysics and Photochemistry of a BODIPY-Based Photosensitizer af Karl Michael Ziems, 9783658261870
Specifikationer
Sprog:
Engelsk
Sider:
139
ISBN-13:
9783658261870
Indbinding:
Paperback
ISBN-10:
3658261870
Kategori:
Udg. Dato:
6 maj 2019
Størrelse i cm:
21,0 x 14,8
Serie:
Oplagsdato:
6 maj 2019
Forfatter(e):

Photophysics and Photochemistry of a BODIPY-Based Photosensitizer

- Quantumchemical Simulations
Engelsk
Paperback 2019
Format:

Bog beskrivelse
Karl Michael Ziems investigates a meso-mesityl-2,6-Iodine substituted Boron Dipyrromethene (BODIPY) dye regarding its functionality as photosensitizer in a two-component light-driven hydrogen evolution. The author uses quantum chemical calculations performed at the time-dependent density functional (TDDFT) and multi-state restricted active space perturbation theory through second-order (MS-RASPT2) level of theory. The light-induced processes associated with the formation of the active photosensitizer, i.e., by means of charge separation, as well as the population of undesired degradative pathways are elucidated. Hereby, the two proposed and investigated mechanisms are based on a heavy atom effect of iodine in the (excited) singlet/triplet manifold and preliminary reduction (of the dye) by a sacrificial electron donor and subsequent photoexcitation.

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Specifikationer
Sprog:
Engelsk
Sider:
139
ISBN-13:
9783658261870
Indbinding:
Paperback
ISBN-10:
3658261870
Kategori:
Udg. Dato:
6 maj 2019
Størrelse i cm:
21,0 x 14,8
Serie:
Oplagsdato:
6 maj 2019
Forfatter(e):
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