Design of Acceptors with Suitable Frontier Molecular Orbitals to Match Donors via Substitutions on Perylene Diimide for Organic Solar Cells

A series of perylene diimide (PDI) derivatives have been investigated at the CAM-B3LYP/6-31G(d) and the TD-B3LYP/6-31+G(d,p) levels to design solar cell acceptors with high performance in areas such as suitable frontier molecular orbital (FMO) energies to match oligo(thienylenevinylene) derivatives...

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Vydáno v:Int J Mol Sci
Hlavní autoři: Lv, Xiaoli, Li, Zhuoxin, Li, Songyang, Luan, Guoyou, Liang, Dadong, Tang, Shanshan, Jin, Ruifa
Médium: Artigo
Jazyk:Inglês
Vydáno: MDPI 2016
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On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC4881543/
https://ncbi.nlm.nih.gov/pubmed/27187370
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms17050721
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