Dear Wien2k user, Thank you very much for your reply. I have changed the OPTIONS as suggested by bu, but it still gives the same error message as earlier.
Please suggest me. With kind regards, On Tue, Jul 10, 2012 at 1:32 PM, Gavin Abo <gsabo at crimson.ua.edu> wrote: > The link advisor ( > http://software.intel.com/en-us/articles/intel-mkl-link-line-advisor/) > settings with MKL 10.0, Linux, Intel 64, Fortran, Static, LP64, Sequential, > Scalapack, and Open MPI: > > $(MKLROOT)/lib/em64t/libmkl_scalapack_lp64.a > $(MKLROOT)/lib/em64t/libmkl_solver_lp64_sequential.a *-Wl,--start-group* > $(MKLROOT)/lib/em64t/libmkl_intel_lp64.a > $(MKLROOT)/lib/em64t/libmkl_sequential.a $(MKLROOT)/lib/em64t/libmkl_core.a > $(MKLROOT)/lib/em64t/libmkl_blacs_openmpi_lp64.a *-Wl,--end-group > -lpthread -lm* > > suggest that your RP_LIBS settings may need to be: > > current:RP_LIBS:-L/opt/intel/cmkl/10.0.1.014/lib/em64t-lmkl_scalapack_lp64 > -lmkl_solver_lp64_sequential > *-Wl,--start-group* -lmkl_intel_lp64 -lmkl_sequential -lmkl_core > -lmkl_blacs_openmpi_lp64 *-Wl,--end-group* *-lpthread > -lm*-L/opt/fftw-2.1.5/lib/lib/ -lfftw_mpi -lrfftw_mpi -lfftw -lrfftw > > > On 7/9/2012 11:02 PM, alpa dashora wrote: > > Dear Prof. Blaha and Wien2k users, > > I am trying to install Wien2k_11.5 in parallel mode on a 8 processors > server. On compilation, it gives the error in lapw1_mpi as follows: > > /opt/intel/cmkl/ > 10.0.1.014/lib/em64t/libmkl_blacs_openmpi_lp64.a(igesd2d_.o)<http://10.0.1.014/lib/em64t/libmkl_blacs_openmpi_lp64.a%28igesd2d_.o%29>: > In function `igesd2d_': > > _igesd2d_.c:(.text+0x43): undefined reference to `ompi_mpi_int' > > _igesd2d_.c:(.text+0x95): undefined reference to `ompi_mpi_byte' > with so many lines. > > The OPTIONS file is as follows: > > current:FOPT:-FR -O3 -mp1 -w -prec_div -pc80 -pad -ip -traceback > -l/opt/openmpi/include > current:FPOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -traceback > current:LDFLAGS:-L/root/WIEN2k_11/SRC_lib -L/opt/intel/cmkl/ > 10.0.1.014/lib/em64t -lmkl_em64t -lmkl_blacs_openmpi_lp64 -lmkl_solver > -lguide -lpthread > current:DPARALLEL:'-DParallel' > current:R_LIBS:-L/opt/intel/cmkl/10.0.1.014/lib/em64t-lmkl_scalapack_lp64 > -lmkl_solver_lp64_sequential -lmkl_intel_lp64 > -lmkl_sequential -lmkl_core -lmkl_blacs_openmpi_lp64 > -L/opt/fftw-2.1.5/lib/lib/ -lfftw_mpi -lrfftw_mpi -lfftw -lrfftw > current:RP_LIBS:-L/opt/intel/cmkl/10.0.1.014/lib/em64t-lmkl_scalapack_lp64 > -lmkl_solver_lp64_sequential -lmkl_intel_lp64 > -lmkl_sequential -lmkl_core -lmkl_blacs_openmpi_lp64 > -L/opt/fftw-2.1.5/lib/lib/ -lfftw_mpi -lrfftw_mpi -lfftw -lrfftw > current:MPIRUN:/opt/openmpi/1.3/bin/mpirun -v -n_NP_ _EXEC_ > Please tell me how to reduce this error. > > *Note:* I am able to run the program with single processor. > > Thanks in advance. > > With kind regards, > > -- > Dr. Alpa Dashora > > > > -- > Alpa Dashora > > > _______________________________________________ > Wien mailing listWien at > zeus.theochem.tuwien.ac.athttp://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > > > > > _______________________________________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > > -- Alpa Dashora -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120710/17481ad8/attachment.htm>