Example of QM/MM solvation free energy calculation input file fails

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6:11:13 AM PST - Mon, Dec 24th 2012
Possible help to you
Xin Li, I think the following link may help you. http://nwchemgit.github.io/Special_AWCforum/st/id567/Error_in_NWChem_Analysis_Modu... Jingbo