[Wien] parallel compilation

[Jeff DeReus]

Hello again.  i am having some issues compiling lapw0/1/2 modules in
wein2k_09.  i am running on a CentOS 5.3 box.  intel non-commercial
compilers and mkl.



here are my current parallel settings from siteconfig.

   Current settings:
     RP  RP_LIB(SCALAPACK+PBLAS):
-L/opt/intel/mkl/10.2.1.017/lib/em64t-lmkl_lapack -lmkl_intel_lp64
-lmkl_scalapack_lp64 -lmkl_blacs_lp64
-lmkl_sequential -L/opt/fftw-2.1.5/lib/ -lfftw_mpi -lfftw -L/opt/mpich2/lib
-lmpich
     FP  FPOPT(par.comp.options): $(FOPT) -FR -mp1 -w -prec_div -pc80 -pad
-align -DINTEL_VML -traceback -I/opt/mpich2/include
-I/opt/fftw-2.1.5/fortran
     MP  MPIRUN commando        : mpiexec _EXEC_

all other modules compile correctly.  if i do not enable parallel
functionality, the compilation completes with no errors.

when compiling /opt/wien2k/SRC_lapw0 it ends with these errors which i have
not been able to track down.

fftw_para.o: In function `exec_fftw_para_':
fftw_para.F:(.text+0x77): undefined reference to `fftwnd_f77_mpi_'
fftw_para.F:(.text+0xb2): undefined reference to `fftwnd_f77_mpi_'
fftw_para.o: In function `init_fftw_para_':
fftw_para.F:(.text+0x101): undefined reference to
`fftw3d_f77_mpi_create_plan_'
fftw_para.F:(.text+0x129): undefined reference to
`fftw3d_f77_mpi_create_plan_'
fftw_para.F:(.text+0x14d): undefined reference to
`fftwnd_f77_mpi_local_sizes_'
make[1]: *** [lapw0_mpi] Error 1
make[1]: Leaving directory `/opt/wien2k/SRC_lapw0'
make: *** [para] Error 2

however, /opt/wien2k/SRC_lapw1/2 end with these errors.

<snip>
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_pdett__d_forward_trig_transform'
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_trans_mkl_comatcopy'
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_pdett_s_init_trig_transform'
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_pdepl_s_commit_helmholtz_3d'
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_pdepl_d_commit_helmholtz_2d'
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_pdett__d_commit_trig_transform'
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_trans_mkl_comatadd'
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_serv_getversionstring_c'
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_spblas_lp64_mkl_dcsrsky'
/opt/intel/mkl/10.2.1.017/lib/em64t/libmkl_intel_lp64.so: undefined
reference to `mkl_pdett__d_init_trig_transform'
make[1]: *** [lapw2c_mpi] Error 1
make[1]: Leaving directory `/opt/wien2k/SRC_lapw2'
make: *** [cp] Error 2


i can find no mention of the fftw3d errors anywhere.

my complete appropriate section of siteconfig

# Linux PC system with IFC 10 compiler + mkl 10 (-ip is broken; -static does
not give traceback-lines)
linuxif9:FC:ifort
linuxif9:MPF:ifort
linuxif9:CC:cc
linuxif9:FOPT:-FR -mp1 -w -prec_div  -pc80 -pad -align -DINTEL_VML
-traceback -O3 -xW
linuxif9:FPOPT:$(FOPT) -FR -mp1 -w -prec_div -pc80 -pad -align -DINTEL_VML
-traceback -I/opt/mpich2/include
linuxif9:LDFLAGS:  $(FOPT) -L/opt/intel/mkl/10.2.1.017/lib/em64t -pthread
-i-static
linuxif9:R_LIBS:-L/opt/intel/mkl/10.2.1.017/lib/em64t -lmkl_lapack -lmkl
-liomp5 -lguide -lmkl_core
linuxif9:DPARALLEL:'-DParallel'
linuxif9:RP_LIBS: -L/opt/intel/mkl/10.2.1.017/lib/em64t -lmkl_lapack
-lmkl_intel_lp64 -lmkl_scalapack_lp64 -lmkl_blacs_lp64 -lmkl_sequential
-L/opt/fftw-2.1.5/lib/ -lfftw_mpi -lfftw
linuxif9:MPIRUN:mpiexec _EXEC_


any assistance in this matter would be appreciated.

Thank you,
JD
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