Computational exploration of the structure-photophysical property relationship of 2,6-dicyanoaniline derivatives for optoelectronic applications
S Sridhar, Rajadurai Vijay Solomon
Topics & Concepts
Density functional theoryChemistryMoleculeHOMO/LUMOContext (archaeology)FormamideAcceptorComputational chemistryAbsorption (acoustics)Hybrid functionalChemical physicsOrganic chemistryMaterials scienceQuantum mechanicsPhysicsComposite materialBiologyPaleontologyNonlinear Optical Materials ResearchOrganic Electronics and PhotovoltaicsConducting polymers and applications