Efficient tuning of zinc phthalocyanine-based dyes for dye-sensitized solar cells: a detailed DFT study
Keyword(s):
Td Dft
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We used a quantum chemical approach to investigate the optoelectronic properties of dyes T1–T5 for dye-sensitized solar cells using DFT and TD-DFT computation. The newly designed molecules exhibited outstanding photovoltaic and optoelectronic properties.