Exploration of second and third order nonlinear optical properties for theoretical framework of organic D–π–D–π–A type compounds
Muhammad Khalid, Muhammad Usman Khan, Riaz Hussain, Shabana Irshad, Bakhat Ali, Ataualpa Albert Carmo Braga, Muhammad Imran, Amjad Hussain
Topics & Concepts
HyperpolarizabilityPolarizabilityNatural bond orbitalBasis setMolecular orbitalMoleculeMaterials scienceBand gapComputational chemistryAcceptorHOMO/LUMONonlinear opticsPolarizable continuum modelAbsorption (acoustics)Atomic orbitalChemical physicsPhysical chemistryChemistryDensity functional theoryNonlinear systemPhysicsOptoelectronicsOrganic chemistryElectronQuantum mechanicsComposite materialCondensed matter physicsSolvationNonlinear Optical Materials ResearchChemical synthesis and pharmacological studiesNonlinear Optical Materials Studies