The effect of chemically functionalized C60-nanocages as sorbents and sensors for methamphetamine drug: A DFT and QTAIM study
Hamid Hadi, Chin-Hung Lai, Daniel C. Agurokpon, Heibbe C. B. de Oliveira, Hitler Louis
Topics & Concepts
NanocagesDensity functional theoryHOMO/LUMOFullereneMoleculeAdsorptionAtoms in moleculesChemistryComputational chemistryNanostructureReactivity (psychology)Chemical shiftPhysical chemistryMaterials scienceNanotechnologyOrganic chemistryCatalysisMedicinePathologyAlternative medicineFullerene Chemistry and ApplicationsBoron and Carbon Nanomaterials ResearchGraphene research and applications