Selectivity adsorption mechanism of different phenolic organic pollutants on UiO-66 by molecular dynamics simulation
Jing Li, Xuanchao Ma, Jun Lan, Ziqi Huang, Tianyu Li, Bin Wang, Lingxiao Wu, Lijun Liang, Xing Duan, Zhe Kong
Topics & Concepts
AdsorptionMolecular dynamicsPollutantMechanism (biology)SelectivityChemistryChemical engineeringChemical physicsComputational chemistryEnvironmental chemistryMaterials scienceOrganic chemistryPhysicsCatalysisQuantum mechanicsEngineeringRadioactive element chemistry and processingCovalent Organic Framework ApplicationsMetal-Organic Frameworks: Synthesis and Applications