Convergence problems with Au cluster

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Fix available
Alessandro,
I managed to reproduce your failure with ifort 2017
Here is a patch that should fix this problem

http://www.nwchem-sw.org/download.php?f=Hfmke.patch.gz

How to apply this patch?

cd $NWCHEM_TOP
wget http://www.nwchem-sw.org/images/Hfmke.patch.gz
gzip -d Hfmke.patch.gz
patch -p0 < Hfmke.patch


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