Litcius/Paper detail

First and second order hyperpolarizabilities of flavonol derivatives: A density functional theory study

Ömer Tamer, Merve Şimşek, Davut Avcı, Yusuf Atalay

2022Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy16 citationsDOI

Topics & Concepts

HyperpolarizabilityElectronegativityDensity functional theoryComputational chemistryChemical shiftChemistryMolecular orbitalCarbon-13 NMRMoleculeAbsorption spectroscopyIonization energyMolecular physicsPhysical chemistryPolarizabilityStereochemistryOrganic chemistryIonizationPhysicsOpticsIonNonlinear Optical Materials ResearchSynthesis and biological activityBioactive Compounds and Antitumor Agents
First and second order hyperpolarizabilities of flavonol derivatives: A density functional theory study | Litcius