Sodium chloride-water mixture: Difference between revisions
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*[http://dx.doi.org/10.1063/1.4728163 J. L. Aragones, E. Sanz, and C. Vega "Solubility of NaCl in water by molecular simulation revisited", Journal of Chemical Physics '''136''' 244508 (2012)] | *[http://dx.doi.org/10.1063/1.4728163 J. L. Aragones, E. Sanz, and C. Vega "Solubility of NaCl in water by molecular simulation revisited", Journal of Chemical Physics '''136''' 244508 (2012)] | ||
*[http://dx.doi.org/10.1063/1.4906320 Zoltan Mester and Athanassios Z. Panagiotopoulos "Mean ionic activity coefficients in aqueous NaCl solutions from molecular dynamics simulations", Journal of Chemical Physics '''142''' 044507 (2015)] | *[http://dx.doi.org/10.1063/1.4906320 Zoltan Mester and Athanassios Z. Panagiotopoulos "Mean ionic activity coefficients in aqueous NaCl solutions from molecular dynamics simulations", Journal of Chemical Physics '''142''' 044507 (2015)] | ||
*[http://dx.doi.org/10.1080/00268976.2015.1011247 Heather Wiebe, Johan Louwersheimer and Noham Weinberg "Molecular dynamic studies of the solubility of sodium chloride: fast calculations using seed crystalline cluster probe", Molecular Physics | *[http://dx.doi.org/10.1080/00268976.2015.1011247 Heather Wiebe, Johan Louwersheimer and Noham Weinberg "Molecular dynamic studies of the solubility of sodium chloride: fast calculations using seed crystalline cluster probe", Molecular Physics '''113''' pp. 3176-3181 (2015)] | ||
Revision as of 19:30, 13 November 2015
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Sodium chloride (NaCl) in water
Models
References
- ↑ David E. Smith and Liem X. Dang "Computer simulations of NaCl association in polarizable water", Journal of Chemical Physics 100 3757 (1994)
- ↑ In Suk Joung and Thomas E. Cheatham "Determination of Alkali and Halide Monovalent Ion Parameters for Use in Explicitly Solvated Biomolecular Simulations", Journal of Physical Chemistry B 112 pp. 9020-9041 (2008)
Related reading
- Martin Lísal, William R. Smith and Jiří Kolafa "Molecular Simulations of Aqueous Electrolyte Solubility: 1. The Expanded-Ensemble Osmotic Molecular Dynamics Method for the Solution Phase", Journal of Physical Chemistry B 109 pp. 12956-12965 (2005)
- Eduardo Sanz and Carlos Vega "Solubility of KF and NaCl in water by molecular simulation", Journal of Chemical Physics 126 014507 (2007)
- Andrew S. Paluch, Saivenkataraman Jayaraman, Jindal K. Shah, and Edward J. Maginn "A method for computing the solubility limit of solids: Application to sodium chloride in water and alcohols", Journal of Chemical Physics 133 124504 (2010)
- M. Paula Longinotti, Marcelo A. Carignano, Igal Szleifer, and Horacio R. Corti "Anomalies in supercooled NaCl aqueous solutions: A microscopic perspective", Journal of Chemical Physics 134 244510 (2011)
- J. L. Aragones, E. Sanz, and C. Vega "Solubility of NaCl in water by molecular simulation revisited", Journal of Chemical Physics 136 244508 (2012)
- Zoltan Mester and Athanassios Z. Panagiotopoulos "Mean ionic activity coefficients in aqueous NaCl solutions from molecular dynamics simulations", Journal of Chemical Physics 142 044507 (2015)
- Heather Wiebe, Johan Louwersheimer and Noham Weinberg "Molecular dynamic studies of the solubility of sodium chloride: fast calculations using seed crystalline cluster probe", Molecular Physics 113 pp. 3176-3181 (2015)