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A joint experimental and computational study on a series of four β-carboxy-corroles, both in free-base and in copper complexes form, is presented. The main goal of the work is to understand by means of high-level DFT and TDDFT calculations the reasons for the low photovoltaic performances obtained for these dyes when employed in dye-sensitized solar cells. We also report a comparison between the unsubstituted...
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