Modelling the effects of salt solutions on the hydration of calcium ions

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Modelling the effects of salt solutions on the hydration of calcium ions

Classical molecular dynamics simulations of several aqueous alkali halide salt solutions have been used to determine the effect of electrolytes on the structure of water and the hydration properties of calcium ions. Compared with the simulations of Ca2+ ions in pure liquid water, the frequency of wa...

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Bibliographic Details
Main Authors:	Di Tommaso, D., Ruiz-Agudo, E., de Leeuw, N., Putnis, Andrew, Putnis, C.
Format:	Journal Article
Published:	R S C Publications 2014
Online Access:	http://hdl.handle.net/20.500.11937/20130

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