Optimized microhydrated Ca(II) clusters Ca(H2O)n at the HF/6-31G* level of theory
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These are the structures of microhydrated Ca(II), optimized at the HF/6-31G* level of theory and explicit water. The clusters have the general formula Ca(H2O)n, where n = 0 to 14. These results correspond to the previously published paper DOI: 10.1007/s00894-012-1707-6
创建时间：
2017-08-24
