[Wien] error while compiling lapw0_mpi

[Peter Blaha]

Not sure about this problem, but:
Did you compile fftw (and openmpi) with cc or icc ??

Am 20.12.2014 um 11:05 schrieb Pascal Boulet:
> 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 <mailto: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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-- 
-----------------------------------------
Peter Blaha
Inst. Materials Chemistry, TU Vienna
Getreidemarkt 9, A-1060 Vienna, Austria
Tel: +43-1-5880115671
Fax: +43-1-5880115698
email: pblaha at theochem.tuwien.ac.at
-----------------------------------------