Investigation of the influence of the location of oxygenated functional groups in graphene nanostructures on water permeation via molecular dynamics simulations
Tze Cheng Kueh, Soon Hong Chew, Ai Kah Soh, Yew Mun Hung
Topics & Concepts
GrapheneMolecular dynamicsPermeationMoleculeChemical physicsOxideHydrogen bondNanostructureChemistryNanotechnologyChemical engineeringMaterials scienceMembraneComputational chemistryOrganic chemistryEngineeringBiochemistryGraphene research and applicationsNanopore and Nanochannel Transport StudiesMembrane Separation Technologies