Mechanism for the adsorption of Per- and polyfluoroalkyl substances on kaolinite: Molecular dynamics modeling
Ze-Wei Ke, Shengjie Wei, Peng Shen, Yunmin Chen, Yuchao Li
Topics & Concepts
AdsorptionKaoliniteMolecular dynamicsPotential of mean forceChemistryAqueous solutionHydrogen bondSulfonateSiloxaneInorganic chemistryChemical physicsChemical engineeringDiffusionMicaMoleculeComputational chemistryOrganic chemistryMaterials scienceThermodynamicsPolymerMineralogyComposite materialSodiumPhysicsEngineeringPer- and polyfluoroalkyl substances researchQuantum Electrodynamics and Casimir EffectCarbon Dioxide Capture Technologies