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. Author manuscript; available in PMC: 2008 Aug 21.
Published in final edited form as: J Phys Chem A. 2007 May 3;111(26):5685–5691. doi: 10.1021/jp070308d

Figure 5.

Figure 5

Minimized structures of the (H2O)13 cluster. CPK model in red (oxygen) and white (hydrogen) is the structure minimized from the Cambridge Cluster Database; CPK model in blue is the lowest-energy conformation identified with the SCCDFTB method.