Investigations on 6FDA/BPDA-DAM polymer melt properties and CO2 adsorption using molecular dynamics simulations
Projesh Kumar Roy, Kishant Kumar, Foram M. Thakkar, Amar Deep Pathak, K. G. Ayappa, Prabal K. Maiti
Topics & Concepts
Molecular dynamicsPolymerMaterials scienceMolecular sieveGas separationMembraneChemical engineeringAdsorptionHildebrand solubility parameterMoleculePolymer chemistryChemistryPhysical chemistryComputational chemistryOrganic chemistryComposite materialEngineeringBiochemistryMembrane Separation and Gas TransportCarbon Dioxide Capture TechnologiesPhase Equilibria and Thermodynamics