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DFT studies of single and multiple alkali metals doped C24 fullerene for electronics and nonlinear optical applications

Naveen Kosar, Hira Tahir, Khurshid Ayub, Tariq Mahmood

2021Journal of Molecular Graphics and Modelling46 citationsDOI

Topics & Concepts

HyperpolarizabilityAlkali metalFullereneBand gapDopingAtom (system on chip)Density functional theoryChemistryElectron affinity (data page)MetalMaterials scienceComputational chemistryPhysical chemistryCrystallographyChemical physicsPolarizabilityMoleculeOrganic chemistryOptoelectronicsEmbedded systemComputer scienceFullerene Chemistry and ApplicationsNonlinear Optical Materials ResearchBoron and Carbon Nanomaterials Research
DFT studies of single and multiple alkali metals doped C24 fullerene for electronics and nonlinear optical applications | Litcius