| 3:41:02 PM PDT - Wed, May 16th 2012 |
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libblas-dev might be the culprit
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Ohlincha,
I have manage to reproduce your failure.
It is due to the fact that the tools autoconf detects the presence of /usr/lib/libblas.a and make some decisions accordingly that
conflicts with what happens on the nwchem side (unfortunately!)
There are two ways to solve this problem (they both require to re-compile the tools directory).
1st Solution: you need patch the tools makefile by doing the following
1) cd $NWCHEM_TOP/src/tools
2) wget http://nwchemgit.github.io/images/Toolsmakefile.patch.gz
3) gzip -d Toolsmakefile.patch
4) patch -p0 < Toolsmakefile.patch
5) make clean
6) make FC=gfortran
7) cd ..
8) make FC=gfortran link
2nd solution: you need to remove the blas system library
1) sudo apt-get remove libblas-dev (you might be forces to remove libatlas-dev, too)
2) cd $NWCHEM_TOP/src/tools
3) make clean
4) make FC=gfortran
5) ..
6) make FC=gfortran link
Please me know if this solves this problem that seems to have affected several NWChem users.
Thanks, Edo
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