New donor-acceptor-donor type of organic semiconductors based on the regioisomers of diketopyrrolopyrroles: A DFT study
Gautomi Gogoi, Labanya Bhattacharya, Shohidur Rahman, Neelotpal Sen Sarma, Sridhar Sahu, Basanta Kumar Rajbongshi, Sagar Sharma
Topics & Concepts
Density functional theoryMaterials scienceCarbazoleAcceptorIntramolecular forceMoietyBinding energyElectron acceptorStructural isomerElectron donorPyrroleComputational chemistryPhotochemistryChemistryStereochemistryOrganic chemistryAtomic physicsCatalysisPhysicsCondensed matter physicsOrganic Electronics and PhotovoltaicsConducting polymers and applicationsMolecular Junctions and Nanostructures