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Raman study on pentacene:C60 bulk heterojunction films
Institution:1. Department of Advanced Science and Engineering, Graduate School of Advanced Science and Engineering, Waseda University, Sinjuku-ku, 169-8555, Tokyo, Japan;2. Department of Chemistry and Biochemistry, Graduate School of Advanced Science and Engineering, Waseda University, Sinjuku-ku, 169-8555, Tokyo, Japan;1. Dipartimento di Scienze Fisiche e Chimiche, Università dell’Aquila, Via Vetoio 2, 67100, Coppito, L’Aquila, Italy;2. Sorbonne Universities, UPMC, Laboratoire de Réactivité de Surface UMR CNRS 7197, Tour 43-53, 3rd floor, 4 Pl. Jussieu, 75005, Paris, France;3. Service de Bioénergétique, Biologie Structurale et Mécanismes (SB2SM) CEA, iBiTec-S, Biochimie Biophysique et Biologie Structurale (B3S), I2BC, UMR 9198, F-91191 Gif-sur-Yvette, France;1. Department of Neurobiology, Institute of Pharmacology, Polish Academy of Sciences, Smętna 12, 31-343 Kraków, Poland;2. Faculty of Foundry Engineering, AGH University of Science and Technology, ul. Reymonta 23, 30-059 Kraków, Poland;3. Institute of Nuclear Physics, Polish Academy of Science, 31-342 Krakow, Poland;4. Faculty of Chemistry, Jagiellonian University, ul. Ingardena 3, 30-060 Kraków, Poland;5. Department of Chemistry, Hankuk University of Foreign Studies, Yongin, Kyunggi-Do, 449-791, South Korea;1. Faculty of Chemistry, Jagiellonian University, Ingardena 3, 30-060 Kraków, Poland;2. Frank Laboratory of Neutron Physics, JINR, 141980 Dubna, Russia;1. Department of Physics, Soongsil University, Seoul 156-743, Republic of Korea;2. Center for Spintronics Research, Korea Institute of Science and Technology, Seoul 136-791, Republic of Korea
Abstract:We measured 785 nm excited Raman and infrared spectra of pentacene-d14. The observed spectra were assigned on the basis of the Raman and infrared spectra calculated by the density functional theory (DFT) method at the B3LYP/6⬜311 + G** level. We measured 785 nm excited Raman spectrum of a pentacne-d14:C60 bulk heterojunction film. The spectrum was assigned on the basis of the wavenumber shifts upon deuteration of pentacene. The assignments of the 1462 and 493 cm↙1 Ag bands of C60 were confirmed. The 511, 453, and 256 cm↙1 bands, which were observed only in pentacene:C60 bulk heterojunction films, did not show large deuteration shifts. This result indicates that the 511, 453, and 256 cm↙1 bands are attributed to activation of the silent modes of C60 due to symmetry lowering.
Keywords:Raman spectroscopy  Organic photovoltaic cells  Bulk heterojunction
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