ArticleRSC advances2022
New organic dye-sensitized solar cells based on the D-A-π-A structure for efficient DSSCs: DFT/TD-DFT investigations.
Article in RSC advances, 2022. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 11 papers.
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11 citing papers in PubMed.
- Modulation of Optoelectronic Performance in N-alkyl-dithieno[3,2 b:2',3' d]pyrrole based Organic Dyes: Insights from DFT/TD-DFT.Journal of fluorescence · 2026Article
- (TD)DFT investigation of donor influence on the electronic and photovoltaic properties of D-π-A-π-A quinoxaline dyes.Journal of molecular modeling · 2026Article
- Frontier Orbital Engineering in Heteroatom-Doped Prototypical Organic Dyes for Dye-Sensitized Solar Cells.The journal of physical chemistry. A · 2026Article
- In silico evaluation of chromene-based D-π-A dyes for high-performance dye-sensitised solar cells.Journal of molecular modeling · 2026Article
- Article
- Design, Synthesis and Photophysical Characterization of 9H-Fluorene Derivative-Based Organic Photosensitizers for Dye-Sensitized Solar Cells.Journal of fluorescence · 2025Article
- Computational investigation on the properties of alkoxysilyl-anchored near-infrared porphyrin dyes for application in dye-sensitized solar cells.Journal of computer-aided molecular design · 2025Article
- Novel push-pull dyes with cyclic ring spacers (titanol, chromol, ferrol, nickelol, and zinkol): a DFT study for optoelectronic optimization in DSSCs.Journal of molecular modeling · 2025Article
- Fine structural tuning of diphenylaniline-based dyes for designing semiconductors relevant to dye-sensitized solar cells.Scientific reports · 2024Article
- DFT and TD-DFT Studies of D-π-A Organic Dye Molecules with Different Spacers for highly Efficient Reliable Dye Sensitized Solar Cells.ChemistryOpen · 2024Article
- Expanding Color Control of Anodically Coloring Electrochromes Based on Electron-Rich 1,4-Dihydropyrrolo[3,2-ACS applied optical materials · 2024Article
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10 authors.
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Abstract
Global energy consumption has increased due to population growth and economic development. Solar energy is one of the most important renewable energy sources for human consumption. In this research, four novel organic dyes (D2-D5) of the D-A-π-A structure based on triphenylamine (TPA) were studied theoretically using DFT and TD-DFT techniques for future usage as dye-sensitized solar cells (DSSCs). The effects of modifying the π-spacer of the reference molecule D1 on the structural, electronic, photovoltaic, and optical characteristics of the D2-D5 dyes were studied in detail. D2-D5 exhibited band gaps (
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