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BY-NC-ND 3.0 license Open Access Published by De Gruyter June 2, 2014

An MD Simulation of Concentrated Aqueous Solutions of Caesium Iodide

  • Y. Tamura , H. Ohtaki and I. Okada

Abstract

Molecular dynamics simulations of concentrated aqueous Csl solutions have been performed for Csl: H2O = 1:20 (2.78 molal) at 298 K and 341 K and 1:10 (5.56 molal) at 349 K. Effects of temperature and concentration on the structures of the hydrated ions, the ion pairs, and ionic aggregates are discussed by comparing the results with X-ray diffraction data obtained under similar conditions [1]

References

Received: 1991-4-12
Published Online: 2014-6-2
Published in Print: 1991-12-1

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This work is licensed under the Creative Commons Attribution-NonCommercial-NoDerivatives 3.0 License.

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