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Optimization of adsorption configuration by DFT calculation for design of adsorbent: A case study of palladium ion-imprinted polymers

Materials ScienceChemical EngineeringEngineeringPolymer ScienceSurface ScienceChemisorptionPalladium Ion-imprinted PolymersPhysical ChemistryAdsorptionChemistryDft CalculationPolymer AnalysisMolecular ImprintingAdsorption ConfigurationPolymer Chemistry