| 1:53:33 PM PST - Mon, Jan 18th 2016 |
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NWChem
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Thanks.
config files are:
https://github.com/proteindj/NWChem_compiling
which mpif90
/opt/openmpi/1.8.4-intel15.0-noib/bin/mpif90
mpif90 -show
ifort -I/opt/openmpi/1.8.4-intel15.0-noib/include -I/opt/openmpi/1.8.4-intel15.0-noib/lib -Wl,-rpath -Wl,/opt/openmpi/1.8.4-intel15.0-noib/lib -Wl,--enable-new-dtags -L/opt/openmpi/1.8.4-intel15.0-noib/lib -lmpi_usempif08 -lmpi_usempi_ignore_tkr -lmpi_mpifh -lmpi
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