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Molecular Simulation of Aqueous Electrolyte Solubility. 2. Osmotic Ensemble Monte Carlo Methodology for Free Energy and Solubility Calculations and Application to NaCl
- 1.MOUČKA, F., LÍSAL, M., ŠKVOR, J., JIRSÁK, J., NEZBEDA, I., SMITH, W.R. Molecular Simulation of Aqueous Electrolyte Solubility. 2. Osmotic Ensemble Monte Carlo Methodology for Free Energy and Solubility Calculations and Application to NaCl. Journal of Physical Chemistry B. 2011, 115(24), 7849-7861. ISSN 1520-6106. E-ISSN 1520-5207. Available: doi: 10.1021/jp202054d
Number of the records: 1