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Fast and efficient optimization of Molecular Dynamics force fields for microporous materials: Bonded interactions via force matching

Materials ScienceEngineeringInterfacial PhenomenonSelf-assemblyForce MatchingMicroporous MaterialsMolecular MaterialInterfacial StudyMolecular MechanicChemistryEfficient OptimizationSoft MatterMolecular DynamicsMolecular Design