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Dye-sensitized solar cells (DSSCs) based on triphenylamine (TPA) as a donor group linked with the acceptor cyanoacrylic acid electron acceptor by 2,2'-bithiophene as π-bridged (D-π-A) has been investigated by Density Functional Theory (DFT) at the B3LYP/6-311G(d,p) level of theory, to establish t...


Fahim, Z.M.E.Bouzzine, S.M.Hamidi, M.M.Bouachrine, M.Hamidi, M.Salgado-Morán, G.Mendoza-Huizar, L.H.Alvarez-Romero, G.A.[Optoelectronic properties of triphenylamine based dyes for solar cell applications. A DFT study]Optoelectronic properties of triphenylamine based dyes for solar cell applications. A DFT study

The structures and electronic properties of a series of cyclometalated Ir(III) complexes with substituted dppz ancillary ligand (dppz: dipyrido[3,2-a:2 ',3 '-c]phenazine) including tert-butyl, pyrrolidine ring, and alkoxys substituents as donor group have been theoretically study. With the aim of...


Dreyse, PaulinaSantander-Nelli, MireyaZamorano, DavidRosales, LuisSanhueza, Luis[Electron-donor substituents on the dppz-based ligands to control luminescence from dark to bright emissive state in Ir(III) complexes]Electron-donor substituents on the dppz-based ligands to control luminescence from dark to bright emissive state in Ir(III) complexes

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