Synthesis, nonlinear optical analysis and DFT studies of D–π–D and A–π–A configured Schiff bases derived from bis-phenylenediamine
Rabia Farooq, Zahra Batool, Muhammad Khalid, Muhammad Usman Khan, Ataualpa Albert Carmo Braga, Ahmed H. Ragab, Saedah R. Al‐Mhyawi, Gulzar Muhammad, Zahid Shafiq
Abstract
e.s.u.), respectively. The observed fascinating NLO properties of these novel compounds might be helpful for further advancement in non-linear optics.
Topics & Concepts
Natural bond orbitalDensity functional theorySchiff baseBasis setChemistryMolecular orbitalBand gapNonlinear opticalSpectroscopyComputational chemistryCrystallographyMoleculeMaterials scienceOptoelectronicsOrganic chemistryPhysicsNonlinear systemQuantum mechanicsNonlinear Optical Materials ResearchChemical synthesis and pharmacological studiesMetal complexes synthesis and properties