2006
DOI: 10.1016/j.molliq.2005.12.004
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Mean distance of closest approach of ions: Sodium salts in aqueous solutions

Abstract: The estimation of numerical values for the mean distance of closest approach of ions, a, of sodium salts in aqueous solutions, determined from activity and diffusion coefficients, and also from different theoretical approaches, is presented and discussed.

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Cited by 14 publications
(7 citation statements)
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“…[46]. That is, the ab initio values and the values calculated from MM2-0 and Marcus data (a = R 1 + R 2 ) are similar, whereas those found from MM2-1 and the other Marcus data (a = d cation-water + d anion-water ), i.e., by considering one water molecule placed in between both ions, are larger.…”
Section: Molecular Mechanics Studies (Mm2)supporting
confidence: 59%
See 1 more Smart Citation
“…[46]. That is, the ab initio values and the values calculated from MM2-0 and Marcus data (a = R 1 + R 2 ) are similar, whereas those found from MM2-1 and the other Marcus data (a = d cation-water + d anion-water ), i.e., by considering one water molecule placed in between both ions, are larger.…”
Section: Molecular Mechanics Studies (Mm2)supporting
confidence: 59%
“…By looking at Table 1, some other analogies with the sodium results [46] are observed. Thus, it can be seen that, in general, the values of a obtained by fitting experimental activity coefficients data are greater than the sum of ionic radii in solution (or crystal-lattice spacing) or the interatomic distances, d ion-ion , what could be explained in terms of the presence of the hydration shell for both cations and anions.…”
Section: Resultsmentioning
confidence: 52%
“…Because there is no any direct method for measuring this value, it must be estimated [17]. Three different estimations were done: a) Two of them came from Marcus data (Table XIII in [18]) by using two approximations.…”
Section: Resultsmentioning
confidence: 99%
“…There is no direct method for measuring the ion size parameter a, the ''mean distance of closest approach'' from the Debye-Huckel theory, but it may be estimated from the data of Marcus (table XIII in [17]), considering two approximations [18][19][20][21][22][23]. The first one considers the a-value as the sum of the ionic radii (R ion ) reported by Marcus [17] (i.e., a = 2.7Á10 À10 m).…”
Section: Resultsmentioning
confidence: 99%