DFT/TDDFT studies on carbazole-antipyrine Schiff base organic dyes containing different πi-spacer for DSSCs applications
Yanjun Wang, Haoyang Zhang, Guodong Tang, Jianying Zhao
Topics & Concepts
ChemistryCarbazoleThiopheneTime-dependent density functional theoryHOMO/LUMOPhotochemistryAcceptorDye-sensitized solar cellSchiff baseDensity functional theoryBand gapOrganic chemistryPhysical chemistryComputational chemistryPolymer chemistryMoleculeOptoelectronicsPhysicsElectrodeElectrolyteCondensed matter physicsTiO2 Photocatalysis and Solar CellsAdvanced Photocatalysis TechniquesConducting polymers and applications