DFT and TD-DFT studies of phenothiazine based derivatives as fluorescent materials for semiconductor applications
Shamsa Bibi, Faiza Farooq, Shafiq‐ur‐Rehman, Fu‐Quan Bai, Hong‐Xing Zhang
Topics & Concepts
Materials scienceTriphenylaminePhenothiazineFluorescenceHOMO/LUMOThiophenePhotochemistryMoleculeAbsorption (acoustics)PopulationDensity functional theoryMolecular orbitalSolvatochromismComputational chemistryOptoelectronicsChemistryOrganic chemistryDemographyMedicinePhysicsComposite materialQuantum mechanicsPharmacologySociologyOrganic Light-Emitting Diodes ResearchOrganic Electronics and PhotovoltaicsLuminescence and Fluorescent Materials