Charge transfer and opto-electronic properties of some newly designed polycatenar discotic liquid crystal derivatives: a DFT study
Bushra Nosheen, Fouzia Perveen, Zaman Ashraf, Abdul Bais, Tayyaba Nооr
Topics & Concepts
Density functional theoryChemistryHOMO/LUMOMarcus theorySubstituentElectron mobilityComputational chemistryPhysical chemistryMaterials scienceOrganic chemistryMoleculeQuantum mechanicsPhysicsReaction rate constantKineticsOptoelectronicsLiquid Crystal Research AdvancementsPhotochemistry and Electron Transfer StudiesSemiconductor Lasers and Optical Devices