Chalcogen-Induced Modulation of Optoelectronic Properties in Tetrahydroquinoline Dyes: Computational Insights for Dye-Sensitized Solar Cells
Chalcogen substitution provides a powerful strategy for tuning the optoelectronic properties of organic sensitizers. Here, Here, twelve tetrahydroquinoline (THQ) based dyes belonging to three parent series (THQ1, THQ2, and THQ3) and incorporating O, S, Se, and Te were systematically investigated using DFT (B3LYP/6-31...