Hi, I installed open-mpi:brew install open-mpi
And evaluate following code in Terminal:export USE_MPI="y"
export NWCHEM_TARGET=MACX64
export NWCHEM_TOP=/Users/me/nwchem-6.6
export USE_INTERNALBLAS="y"
export CFLAGS_FORGA="-DMPICH_NO_ATTR_TYPE_TAGS"
cd /Users/me/nwchem-6.6/src
make nwchem_config
make
The installation process lasted more than an hour but after:
...
Undefined symbols for architecture x86_64:
"_caxpy", referenced from:
__acc in libarmci.a(comex.o)
"_daxpy", referenced from:
__acc in libarmci.a(comex.o)
(maybe you meant: _daxpy3_, _pack_tt_daxpy_ , _grsm_gg_daxpy_ , _grsm_gmg_daxpy_ , _LP_daxpy , _dneall_mm_daxpy_ , _d3db_rr_daxpy_ , _d3db_cc_daxpy_ , _cram_rr_daxpy_ , _c3db_cc_daxpy_ , _cram_cc_daxpy_ , _daxpy_ , _daxpyfile_ , _pack_cc_daxpy_ , _c3db_rr_daxpy_ )
"_saxpy", referenced from:
__acc in libarmci.a(comex.o)
"_zaxpy", referenced from:
__acc in libarmci.a(comex.o)
(maybe you meant: _pack_cc_zaxpy_, _zaxpy_ , _c3db_cc_zaxpy_ , _d3db_cc_zaxpy_ , _cram_cc_zaxpy_ )
ld: symbol(s) not found for architecture x86_64
collect2: error: ld returned 1 exit status
make: *** [all] Error 1
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