Theoretical and experimental investigation of a pyridinium-based NLO crystal 4-N, N-dimethylamino-4′-N′-methyl-stilbazolium 3,4-dimethoxysulfonate
Rui Chen, Kai Xu, Guanjun Wang, Zhiwei Zhang, Lifeng Cao, Bing Teng
Topics & Concepts
HyperpolarizabilityPyridiniumPolarizabilityCrystal (programming language)Density functional theorySecond-harmonic generationMaterials scienceDipoleMolecular orbitalIntermolecular forceMolecular physicsComputational chemistryChemistryMoleculeOpticsPhysicsOrganic chemistryProgramming languageLaserComputer scienceNonlinear Optical Materials ResearchCrystal structures of chemical compoundsSolid-state spectroscopy and crystallography