DFT study of effect of substituents on second-order NLO response of novel BODIPY dyes
Huimin Kang, Jin-Ting Ye, Hong-Qiang Wang, Yuan Zhang, Yong‐Qing Qiu
Topics & Concepts
BODIPYIntramolecular forceChemistryDelocalized electronPolarizabilityComputational chemistryMolecular orbitalDensity functional theoryPolar effectPhotochemistryStereochemistryOrganic chemistryMoleculeFluorescencePhysicsQuantum mechanicsNonlinear Optical Materials ResearchLuminescence and Fluorescent MaterialsPorphyrin and Phthalocyanine Chemistry