The role of the donor group and electron-accepting substitutions inserted in π-linkers in tuning the optoelectronic properties of D–π–A dye-sensitized solar cells: a DFT/TDDFT study
Hossein Roohi, Nafiseh Mohtamadifar
Abstract
of JK-POZ-3 and JK-PTZ-3 dyes are superior to those of JK-201, indicating that novel JK-POZ-3 and JK-PTZ-3 dyes could be promising candidates for improving the efficiency of the DSSCs devices.
Topics & Concepts
Time-dependent density functional theoryDye-sensitized solar cellElectron donorAcceptorElectronGroup (periodic table)Series (stratigraphy)MetalMaterials scienceOptoelectronicsElectron acceptorChemistryPhotochemistryDensity functional theoryComputational chemistryPhysical chemistryCondensed matter physicsPhysicsOrganic chemistryElectrodeQuantum mechanicsBiologyElectrolytePaleontologyCatalysisTiO2 Photocatalysis and Solar CellsQuantum Dots Synthesis And PropertiesPerovskite Materials and Applications