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Molecular dynamics simulations and COSMO-RS method for CO2 capture in imidazolium and pyrrolidinium-based room-temperature ionic liquids

Solid-state IonicChemical EngineeringEngineeringCo2 CaptureIonic ConductorMolecular Dynamics SimulationsCosmo-rs MethodPhysical ChemistryComputational ChemistryChemistryDeep Eutectic SolventMolecular DynamicsIon Structure