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. 2017 Mar 9;7:44255. doi: 10.1038/srep44255

Figure 1. ln β of hydrated Ca2+ ion.

Figure 1

The ln β values of Ca(H2O)n2+ (n: 6, 7, or 8) are shown together with the literature values42,44 obtained for [Ca(H2O)n](H2O)m2+ (n: 6 or 8, m: 12, 14, or 16) with or without the solvation model (COSMO: conductor like screening model). Solid marks (in vacuo), open marks (CPCM or COSMO)42.