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Molecular structure of finely disperse Na+Cl−(H2O) n aerosol particles in water vapor

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Abstract

The thermodynamic states corresponding to solvent separated (SSIP) and contacting (CIP) Na+Cl− ion pairs in molecular water clusters have been obtained by random walks in a configurational space with an equilibrium distribution function at 273 and 150 K. The transition to the SSIP state begins in a thresh-old-type manner in clusters containing 10–12 molecules, with the interionic distance increasing continuously up to disintegration into two hydrated ions with the growth of a hydration shell. As the cluster size increases, the hydration shell shifts from sodium ion to chlorine ion. In the first hydration layer, the electric field of the ions ruptures as many as 50% of hydrogen bonds.

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Authors and Affiliations

  1. St. Petersburg State Polytechnical University, ul. Politekhnicheskaya 29, St. Petersburg, 195251, Russia

    S. V. Shevkunov

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Correspondence to S. V. Shevkunov.

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Original Russian Text © S.V. Shevkunov, 2014, published in Kolloidnyi Zhurnal, 2014, Vol. 76, No. 6, pp. 805–816.

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Shevkunov, S.V. Molecular structure of finely disperse Na+Cl−(H2O) n aerosol particles in water vapor. Colloid J 76, 753–764 (2014). https://doi.org/10.1134/S1061933X14050123

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