DFT Study of bis(1,10-phenanthroline)copper complexes: Molecular and electronic structure, redox and spectroscopic properties and application to Solar Cells
Jeanet Conradie
Topics & Concepts
RedoxChemistryDensity functional theoryDye-sensitized solar cellIodideElectron transferTriiodidePhenanthrolinePhotochemistryTime-dependent density functional theoryIntramolecular forceExcited stateSolar cellComputational chemistryElectrolyteInorganic chemistryPhysical chemistryMaterials scienceStereochemistryElectrodeOptoelectronicsAtomic physicsPhysicsTiO2 Photocatalysis and Solar CellsAdvanced Photocatalysis TechniquesPorphyrin and Phthalocyanine Chemistry