Tuning of a A–A–D–A–A-Type Small Molecule with Benzodithiophene as a Central Core with Efficient Photovoltaic Properties for Organic Solar Cells
Urwah Azeem, Rasheed Ahmad Khera, Ayesha Naveed, Muhammad Imran, Mohammed A. Assiri, Muhammad Khalid, Javed Iqbal
Abstract
(0.0146 eV). All the designed molecules are good candidates for ASM-OSCs owing to their superior and optimized properties.
Topics & Concepts
Organic solar cellDensity functional theoryExcitonMoleculeAcceptorChemistryAbsorption spectroscopyBinding energyBand gapHOMO/LUMOExcited stateAbsorption (acoustics)Materials scienceChemical physicsAtomic physicsComputational chemistryPolymerOptoelectronicsPhysicsCondensed matter physicsComposite materialOrganic chemistryQuantum mechanicsOrganic Electronics and PhotovoltaicsConducting polymers and applicationsQuantum Dots Synthesis And Properties