Computational method on highly efficient D-π-A-π-D-based different molecular acceptors for organic solar cells applications and non-linear optical behaviour
Ammasi Arunkumar, Xue‐Hai Ju
Topics & Concepts
ChemistryTime-dependent density functional theoryDensity functional theoryOrganic solar cellIntramolecular forceMarcus theoryExcited stateAcceptorElectron acceptorMolecular orbitalHOMO/LUMOOscillator strengthMoleculeDebyeElectron affinity (data page)Chemical physicsComputational chemistryPhotochemistryAtomic physicsSpectral linePolymerOrganic chemistryPhysicsCondensed matter physicsQuantum mechanicsReaction rate constantAstronomyKineticsOrganic Electronics and PhotovoltaicsNonlinear Optical Materials ResearchConducting polymers and applications