[CP2K:4257] Parallel cp2k installation trouble
Jana
jahodov... at gmail.com
Mon Jan 21 16:32:03 UTC 2013
Hi Alin,
I've loaded modules gcc-4.5.2, mpich2-intel and intelcdk-12 (for ifort).
I used the arch file according to uname:
Linux 2.6.26-2-xen-amd64 #1 SMP Thu Apr 26 19:04:13 CEST 2012 x86_64 x86_64
x86_64 GNU/Linux
For the compilation from the makefiles directory I go just
$ make -j 20 ARCH=Linux-x86-64-intel VERSION=popt
Here's the arch file
CC = cc
CPP =
FC = ifort
LD = ifort
AR = ar -r
DFLAGS = -D__INTEL -D__FFTSG -D__parallel -D__SCALAPACK -D__BLACS
-D__LAPACK -D__BLAS -D__FFTW3 -D__LIBINT
CPPFLAGS =
FCFLAGS = $(DFLAGS) -I$(INTEL_INC) -O3 -xW -heap-arrays 64 -funroll-loops
-fpp -free
# FCFLAGS2 = $(DFLAGS) -I$(INTEL_INC) -O1 -xW -heap-arrays 64 -fpp -free
LDFLAGS = $(FCFLAGS) -I$(INTEL_INC)
LIBS = -l/home/mathausj/lib_sc/libscalapack.a \
-l/home/mathausj/BLACS/LIB/blacsF77init_MPI-LINUX-1.a \
-l/home/mathausj/BLACS/LIB/blacs_MPI-LINUX-1.a \
-l/home/mathausj/atl_jm/lib/liblapack.a \
-l/home/mathausj/atl_jm/lib/libptlapack.a \
-l/home/mathausj/atl_jm/lib/libatlas.a \
-l/home/mathausj/atl_jm/lib/libcblas.a \
-l/home/mathausj/atl_jm/lib/libf77blas.a \
-l/home/mathausj/atl_jm/lib/libf77refblas.a \
-l/home/mathausj/atl_jm/lib/libptf77blas.a \
-l/home/mathausj/atl_jm/lib/libsatlas.so \
-l/home/mathausj/atl_jm/lib/libtatlas.so \
-l/home/mathausj/atl_jm/lib/libtstatlas.a \
-l/home/mathausj/fftw/lib/libfftw3.a \
-l/home/mathausj/libint/adep/lib/libint2.a \
OBJECTS_ARCHITECTURE = machine_intel.o
graphcon.o: graphcon.F
$(FC) -c $(FCFLAGS2) $<
On Monday, January 21, 2013 5:13:42 PM UTC+1, Alin Marin Elena wrote:
>
> Hi Jana,
>
>
>
> Can you please post the arch file you are using.. and the compiler
> versions...
>
> also the commands you use are to generate the error.
>
>
>
> Alin
>
>
>
>
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> ______________________________________________________________________
>
> Alin Marin ELENA
>
> Advanced Molecular Simulation Research Laboratory
>
> School of Physics, University College Dublin
>
> ----
>
> Ardionsamblú Móilíneach Saotharlann Taighde
>
> Scoil na Fisice, An Coláiste Ollscoile, Baile Átha Cliath
>
>
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>
> -----------------------------------------------------------------------------------
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> http://alin.elenaworld.net
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