Enhancement in non-linear optical properties of carbon nitride (C2N) by doping superalkali (Li3O): A DFT study
Talha Ishfaq, Rasheed Ahmad Khera, Saba Zahid, Umer Yaqoob, Rao Aqil Shehzad, Khurshid Ayub, Javed Iqbal
Topics & Concepts
HyperpolarizabilityChemistryCarbon nitrideDensity functional theoryDopingNitrideBand gapBasis setCarbon fibersDipoleIonization energyComputational chemistryOptoelectronicsMoleculeIonizationMaterials scienceOrganic chemistryPolarizabilityIonCatalysisPhotocatalysisLayer (electronics)Composite numberComposite materialNonlinear Optical Materials ResearchNonlinear Optical Materials StudiesBoron and Carbon Nanomaterials Research