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. Author manuscript; available in PMC: 2017 Feb 6.
Published in final edited form as: J Phys Chem B. 2015 Jul 31;119(32):10275–10286. doi: 10.1021/acs.jpcb.5b01295

Figure 3.

Figure 3

ΔEnn−1 = EMg2+(H2O)nEMg2+(H2O)n−1 Energies of a water molecule removal from Mg2+(H2O)n clusters, where n is the number of water molecules in the cluster. Energies are computed using different force-fields as indicated in the legend in the graph.