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A TD-DFT investigation of two-photon absorption of fluorene derivatives

✍ Scribed by Zein, S. ;Delbecq, F. ;Simon, D.

Book ID: 121265891
Publisher: Royal Society of Chemistry
Year: 2009
Tongue: English
Weight: 918 KB
Volume: 11
Category: Article
ISSN: 1463-9076
DOI: 10.1039/B808965E

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## Abstract The structural and electronic properties of fluorene‐phenylene copolymer (FP)__~n~, n__ = 1–4 were studied by means of quantum chemical calculations based on density functional theory (DFT) and time dependent density functional theory (TD‐DFT) using B3LYP functional. Geometry optimizati