[Wien] undefined reference

ahmed amine ahmedamine_dz at hotmail.fr
Tue Feb 28 17:49:17 CET 2017


Hello,


I'm trying to compile Wien2k16.1 on cluster with

intel/icc-12.1.3
intel/ifort-12.1.0
openmpi/2.0
fftw/3.3.5

 I get the following error


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
W2kinit.o: In function `w2kinit_':
W2kinit.F:(.text+0x517): undefined reference to `vmlsetmode_'
normal.o: In function `normal_':
normal.f:(.text+0x1cf): undefined reference to `zdscal_'
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a(blacs_extended.o): In function `MKL_BLACS_Deallocate':
_blacs_extended.c:(.text+0x702): undefined reference to `mkl_serv_deallocate'
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a(blacs_extended.o): In function `MKL_BLACS_ALLOCATE':
_blacs_extended.c:(.text+0x72e): undefined reference to `mkl_serv_allocate'
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_scalapack_lp64.so: undefined reference to `ssteqr_'
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_scalapack_lp64.so: undefined reference to `dsyr2k_'
/opt/intel/composer_xe_2011_sp1.9.293/mkl/lib/intel64/libmkl_scalapack_lp64.so: undefined reference to `cscal_'

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