[Wien] error while compiling lapw0_mpi

Pascal Boulet pascal.boulet at univ-amu.fr
Sat Dec 20 11:05:13 CET 2014


Dear all,

I have downloaded version 14 of Wien2K. I am trying to compile it on a Intel Xeon parallel computer with ifort(13)/openmpi(1.6.3)/fftw(3.3).

I am facing a problem with compiling lapw0_mpi. The error message is shown below.

/usr/local/fftw-3.3-intel/include/fftw3-mpi.f03(33): error #5082: Syntax error, found ')' when expecting one of: ( * <IDENTIFIER> <CHAR_CON_KIND_PARAM> <CHAR_NAM_KIND_PARAM> <CHARACTER_CONSTANT> ...
      integer(), value :: comm
--------------^

The other lapwX_mpi packages compile fine and work well.


Has anyone seen this message before?

Thank you for your help.

Pascal


For sake of completeness here are the various compilation options:

Compilers:
ifort/cc/mpif90

Parallel options:
setenv TASKSET "no"
setenv USE_REMOTE 0
setenv MPI_REMOTE 0
setenv WIEN_GRANULARITY 1
setenv WIEN_MPIRUN "mpirun -np _NP_ -machinefile _HOSTS_ _EXEC_ »

Compiler options and libraries:
current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback -assume buffered_io
current:FPOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -traceback -assume buffered_io
current:FFTW_OPT:-DFFTW3 -I/usr/local/fftw-3.3-intel/include
current:FFTW_LIBS:-lfftw3_mpi -lfftw3 -L/usr/local/fftw-3.3-intel/lib
current:LDFLAGS:$(FOPT) -L$(MKLROOT)/lib/$(MKL_TARGET_ARCH) -pthread
current:DPARALLEL:'-DParallel'
current:R_LIBS:-lmkl_lapack95_lp64 -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -openmp -lpthread
current:RP_LIBS:-lmkl_scalapack_lp64 -lmkl_blacs_lp64 $(R_LIBS)
current:MPIRUN:mpirun -np _NP_ -machinefile _HOSTS_ _EXEC_
current:MKL_TARGET_ARCH:intel64



Pascal Boulet

--
pascal.boulet at univ-amu.fr
Aix-Marseille University
MADIREL Laboratory
Avenue Normandie-Niemen
F-13397 Marseille Cedex 20
Tel.: +33 413.55.18.10
Fax: +33 413.55.18.50
http://allos.up.univ-mrs.fr/pascal/
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