Designing Star-Shaped Subphthalocyanine-Based Acceptor Materials with Promising Photovoltaic Parameters for Non-fullerene Solar Cells
Muhammad Usman Khan, Muhammad Khalid, Muhammad Nadeem Arshad, Muhammad Naeem Khan, Muhammad Usman, Akbar Ali, Saifullah Bullo
Abstract
. Our results suggest that the selected molecules are fine acceptor materials and can be used as electron and/or hole transport materials with excellent photovoltaic properties for OSCs.
Topics & Concepts
Density functional theoryTime-dependent density functional theoryOrganic solar cellOpen-circuit voltageAcceptorMoleculeBand gapHOMO/LUMOAbsorption spectroscopyMaterials scienceAbsorption (acoustics)Electron acceptorChemistryPhotochemistryComputational chemistryOptoelectronicsVoltagePhysicsOpticsOrganic chemistryPolymerQuantum mechanicsComposite materialCondensed matter physicsOrganic Electronics and PhotovoltaicsMolecular Junctions and NanostructuresPorphyrin and Phthalocyanine Chemistry