Publication | Open Access

Molecular dynamics simulation of framework flexibility effects on noble gas diffusion in HKUST-1 and ZIF-8

Molecular KineticsMolecular SolidMolecular DynamicsEngineeringPhysicsNatural SciencesApplied PhysicsPhysical ChemistryMolecular Dynamics SimulationMathematical ChemistryComputational ChemistryMolecular MechanicChemistryQuantum ChemistryFramework Flexibility EffectsNoble Gas DiffusionChemical Kinetics