The role of hydroxyl and carboxyl functional groups in adsorption of copper by carbon nanotube and hybrid graphene–carbon nanotube: insights from molecular dynamic simulation
Mahdiye Poorsargol, Zohreh Razmara, Mir Masumeh Amiri
Topics & Concepts
GrapheneCarbon nanotubeAdsorptionNanotubeAqueous solutionFunctional groupCopperMolecular dynamicsChemistryMaterials scienceDensity functional theoryCarbon fibersInorganic chemistryChemical engineeringNanotechnologyOrganic chemistryComposite numberComputational chemistryComposite materialPolymerEngineeringGraphene and Nanomaterials ApplicationsAdsorption and biosorption for pollutant removalGraphene research and applications