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• W2034656088 endingPage "789" @default.
• W2034656088 startingPage "786" @default.
• W2034656088 abstract "“Like-charge attraction” is a phenomenon found in many biological systems containing DNA or proteins, as well as in polyelectrolyte systems of industrial importance. “Like-charge attraction” between polyanions is observed in the presence of mobile multivalent cations. At a certain limiting concentration of cations, the negatively charged macroions cease to repel each other and even an attractive force between the anions is found. With classical molecular dynamics simulations it is possible to elucidate the processes that govern the attractive behavior with atomistic resolution. As an industrially relevant example we study the interaction of negatively charged carboxylate groups of sodium polyacrylate molecules with divalent cationic Ca2+ counterions. Here we show that Ca2+ ions initially associate with single chains of polyacrylates and strongly influence sodium ion distribution; shielded polyanions approach each other and eventually “stick” together (precipitate), contrary to the assumption that precipitation is initially induced by intermolecular Ca2+ bridging." @default.
• W2034656088 created "2016-06-24" @default.
• W2034656088 creator A5031395347 @default.
• W2034656088 creator A5051414481 @default.
• W2034656088 date "2004-12-14" @default.
• W2034656088 modified "2023-09-25" @default.
• W2034656088 title "“Like-Charge Attraction” between Anionic Polyelectrolytes: Molecular Dynamics Simulations" @default.
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• W2034656088 doi "https://doi.org/10.1021/la048057c" @default.
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• W2034656088 hasPublicationYear "2004" @default.
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