Molecular dynamics analysis of Li+/Mg2+ transport mechanism in COF membranes with flexible oxygen-containing side chains
Jianguo Li, Qiang Xie, Chen Chen, Lingqi Wang, Li Zhang
Topics & Concepts
MembraneSide chainChemistryMechanism (biology)OxygenMolecular dynamicsPolymer chemistryChemical engineeringComputational chemistryOrganic chemistryPolymerPhysicsBiochemistryEngineeringQuantum mechanicsFuel Cells and Related MaterialsMembrane-based Ion Separation TechniquesCovalent Organic Framework Applications