A new metal-organic hybrid material: Synthesis, structural, electro-optical properties and quantum chemical investigation
V. Siva, A. Murugan, A. Shameem, S. Athimoolam, S. Asath Bahadur
Topics & Concepts
Molecular orbitalHOMO/LUMODielectricMaterials scienceDensity functional theoryCrystal (programming language)Hydrogen bondMoleculeAtomic orbitalCrystallographyPhysical chemistryComputational chemistryChemistryOptoelectronicsOrganic chemistryPhysicsComputer scienceQuantum mechanicsElectronProgramming languageNonlinear Optical Materials ResearchCrystal Structures and PropertiesSolid-state spectroscopy and crystallography