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<div class="moz-cite-prefix">undefined reference to `ssteqr_' =>
I believe that is a lapack function. I don't see the lapack
library (-lmkl_lapack95_lp64) in the mpif90 line of your post.<br>
<br>
In siteconfig, the -lmkl_lapack95_lp64 should be in your serial
R_LIB settings. Then, $(R_LIBS) should be in your parallel RP_LIB
settings similar to what you see in the post at:<br>
<br>
<a class="moz-txt-link-freetext" href="http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg07331.html">http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg07331.html</a><br>
<br>
On 2/28/2017 9:49 AM, ahmed amine wrote:<br>
</div>
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cite="mid:DM2PR0201MB10860999C65F8D36DBAFB359F0560@DM2PR0201MB1086.namprd02.prod.outlook.com"
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<p>Hello, <br>
</p>
<p><br>
</p>
<p><span>I'm trying to compile Wien2k16.1 on cluster with </span></p>
<div>intel/icc-12.1.3<br>
intel/ifort-12.1.0 <br>
<span>openmpi/2.0</span><br>
</div>
<span>fftw/3.3.5</span>
<p><br>
<b> <tt>I get the following </tt><tt>error</tt></b></p>
<p><br>
</p>
mpif90 -o dstart_mpi module.o W2kinit.o atom_read.o
atom_write.o atom_superpos.o charge.o cputim.o cub_xc_back.o
deter.o dstart.o errclr.o errflg.o getfft.o gpoint.o gtfnam.o
init.o integrn.o inter_superpos.o inter_write.o kapp.o
kdelta.o ifflim.o make_inter.o make_neigh_list.o
make_spheres.o normal.o old_dstart.o outerr.o recpr.o rgen.o
rotate.o rotdef.o setn.o somm1.o somm2.o stern.o somm.o
sortag.o suml.o sumfac.o SymmRot.o W2kutils.o ylm.o zfft3d.o
-O1 -FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML
-traceback -assume buffered_io
-I/opt/intel/composer_xe_2011_sp1.7.256/mkl:/opt/intel/composer_xe_2011_sp1.9.293/mkl/include
-DFFTW3 -I/usr/lib64/fftw-3.3.5-mpi/include
-L/opt/intel/composer_xe_2011_sp1.7.256/mkl:/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/
-pthread -lfftw3_mpi -lmkl_scalapack_lp64
-lmkl_blacs_openmpi_lp64 <br>
W2kinit.o: In function `w2kinit_':<br>
W2kinit.F:(.text+0x517): undefined reference to `vmlsetmode_'<br>
normal.o: In function `normal_':<br>
normal.f:(.text+0x1cf): undefined reference to `zdscal_'<br>
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a(blacs_extended.o):
In function `MKL_BLACS_Deallocate':<br>
_blacs_extended.c:(.text+0x702): undefined reference to
`mkl_serv_deallocate'<br>
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a(blacs_extended.o):
In function `MKL_BLACS_ALLOCATE':<br>
_blacs_extended.c:(.text+0x72e): undefined reference to
`mkl_serv_allocate'<br>
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_scalapack_lp64.so:
undefined reference to `ssteqr_'<br>
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_scalapack_lp64.so:
undefined reference to `dsyr2k_'<br>
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_scalapack_lp64.so:
undefined reference to `cscal_'</div>
</div>
</blockquote>
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