| 3:22:05 PM PDT - Mon, Jul 15th 2013 |
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The machine I am running on is an Intel Nehalem (Intel Xeon Family: 6 Model: 26 Stepping: 5) with 2 HW threads per core, 4 cores per socket, 2 sockets .. resulting in a total of 16 processing units.
OS: Scientific Linux release 6.3 (Carbon) (linux kernel 2.6.32)
I am using the following compiler version:
$ ifort --version
ifort (IFORT) 13.1.1 20130313
And OpenMPI version 1.6.3
My env variables:
export NWCHEM_TOP=/home/mccraw/01_work/NWChem_ISCD/nwchem-6.3-src.2013-05-28
export NWCHEM_TARGET=LINUX64
export NWCHEM_MODULES=all
$ make nwchem_config
$ make FC="ifort -I/opt/ompi-1.6.3/include -pthread -L/opt/hwloc/lib -L/opt/ompi-1.6.3/lib -lmpi_f90 -lmpi_f77 -lmpi -ldl -lhwloc -Wl,--export-dynamic -lrt -lnsl -lutil -lm -ldl -Wl,-rpath -Wl,/opt/hwloc/lib -Wl,-rpath -Wl,/opt/hwloc/lib" >& make.log
Yes, I am using NWChem 6.3.
The content of the file $NWCHEM_TOP/src/tools/.build/config.log is uploaded at:
http://web.eecs.utk.edu/~mccraw/config.log
Thanks again for any help,
heike.
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