NWCHEM Cannot Run On the Environment Although It Is Built
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Forum Vet
7:18:22 AM PST - Thu, Feb 2nd 2017
If only the patch for mac is applied, the result calculated is the same.
Dft_he2+.nw gives the same results as those in dft_he+.out, both slightly different from those in dft_he+.out_old.