Modeling selective ion adsorption into cylindrical nanopores
Chemical Physics Letters(2018)
摘要
•Classical density functional theory is used to study ion selectivity.•A neutral pore selects large ions, regardless of the pore size and ion composition.•A large charged pore prefers adsorption of small counterions.•A small charged pore selects large counterions.
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关键词
Ion selectivity,Cylindrical pore,Density functional theory
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