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Efficient tuning of zinc phthalocyanine-based dyes for dye-sensitized solar cells: a detailed DFT study

The growing energy demand speed up the designing of competent photovoltaic materials. Herein, five zinc phthalocyanine-based donor materials T1–T5 are designed by substituting various groups (isopropoxy, cyano, fluoro, methoxycarbonyl, and dicyanomethyl) around zinc phthalocyanine. B3LYP/6-31G (d,p)...

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Detalles Bibliográficos
Autores principales:	Siddique, Sabir Ali, Arshad, Muhammad, Naveed, Sabiha, Mehboob, Muhammad Yasir, Adnan, Muhammad, Hussain, Riaz, Ali, Babar, Siddique, Muhammad Bilal Ahmed, Liu, Xin
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	The Royal Society of Chemistry 2021
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9037920/ https://www.ncbi.nlm.nih.gov/pubmed/35480647 http://dx.doi.org/10.1039/d1ra04529f

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