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Sarah A. Ayoub

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Open access Aug 2026

DFT/CAM-B3LYP analysis of intermolecular interactions and morphological stability of binary PTB7-Th/Y6 blends in organic solar cells

Y6 and PTB7-Th are widely used acceptor and donor materials in high-efficiency organic solar cells; however, their binary blends are known to suffer from poor long-term morphological stability. Here, we provide a molecular-level explanation for this instability using a systematic density functional theory (DFT) conform...

Sarah A. Ayoub, J. Lagowski · 0 citations

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