Impact of the acceptor units on optoelectronic and photovoltaic properties of (XDADAD)n-type copolymers: Computational and experimental study
Autor: | Alexander F. Shestakov, Irina V. Klimovich, Ilya V. Martynov, Alexander V. Akkuratov, N.V. Tukachev, Andriy Zhugayevych, Fedor A. Prudnov, Olga Mazaleva, Alexander S. Peregudov, Pavel A. Troshin |
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Rok vydání: | 2021 |
Předmět: |
chemistry.chemical_classification
Materials science Benzotriazole Organic solar cell business.industry Process Chemistry and Technology General Chemical Engineering 02 engineering and technology Polymer Conjugated system 010402 general chemistry 021001 nanoscience & nanotechnology 01 natural sciences Acceptor Polymer solar cell 0104 chemical sciences chemistry.chemical_compound Quinoxaline chemistry Thiophene Optoelectronics 0210 nano-technology business |
Zdroj: | Dyes and Pigments. 185:108899 |
ISSN: | 0143-7208 |
DOI: | 10.1016/j.dyepig.2020.108899 |
Popis: | A series of ten conjugated polymers incorporating in their molecular frameworks extended DADAD building blocks with thiophene donor (D) and either benzotriazole, benzoxadiazole, benzothiadiazole, difluorobenzothiadiazole or quinoxaline acceptor (A) units were synthesized and characterized. The optoelectronic properties of new polymers were computed and experimentally investigated revealing a good relationship, which can guide further rational design of materials with tailored properties for organic photovoltaics using in-silico approaches. The performance of all polymers in organic bulk heterojunction solar cells was compared and some important empirical rules were formulated for reaching the best photovoltaic performance from (X-DADAD)n family of polymers. |
Databáze: | OpenAIRE |
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