| 11:31:50 AM PST - Wed, Nov 27th 2013 |
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Hi Vincent,
I looked into this and the problem was mainly a bit of plumbing passing the right information around. So I have just fixed this and checked it into the development version. I have uploaded a patch for this problem.
These are the steps needed to apply the patch
1) cd $NWCHEM_TOP
2) wget http://nwchemgit.github.io/images/Cgmin-DoubleHybrid.patch.gz
3) gzip -d Cgmin-DoubleHybrid.patch.gz
4) patch -p0 < Cgmin-DoubleHybrid.patch
5) recompile
Best wishes, Huub
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