[Wien] error while compiling lapw0_mpi

[Pascal BOULET]

Dear Peter,

Difficult to say: I am using a fftw module compiled by the IT manager of the supercomputer. I am going to try to solve the problem with him.

Thank you for your response.
Best,
Pascal

> ----------------------------------------
> From: Peter Blaha <pblaha at theochem.tuwien.ac.at>
> Sent: Sat Dec 20 15:32:38 CET 2014
> To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
> Subject: Re: [Wien] error while compiling lapw0_mpi
> 
> 
> 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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> > Wien at zeus.theochem.tuwien.ac.at
> > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> > SEARCH the MAILING-LIST at:  http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
> >
> 
> -- 
> -----------------------------------------
> 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
> -----------------------------------------
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>-----------------
Pascal Boulet
Aix-Marseille University 
MADIREL Laboratory
Avenue Normandie-Niemen
13397 Marseille Cedex 20
Email: pascal.boulet at univ-amu.fr
Tel. +33 413 55 18 10
Fax  +33 413 55 18 50