ABINIT Discussion Forums

Hello, Now with openmpi 1.6.5 and gcc 4.4.7 it compiles fine. When I run one of my test I'm getting: ABINIT Give name for formatted input file: tparal_1.in Give name for formatted output file: tparal_1.out Give root name for generic input files: tparal_1i Give root name for generic output files: tpa...

Hello, I've have still the same problem ... could it be caused by the old mpi version? I have openmpi-icc-1.5.4-1. Here is my current configuration file: enable_mpi="yes" enable_mpi_io="yes" with_mpi_prefix="/usr/lib64/openmpi-icc" with_fft_flavor="fftw3" with...

Hello, I've change this and get: -------------------------------------------------------------------------- MPI_ABORT was invoked on rank 0 in communicator MPI_COMM_WORLD with errorcode 14. NOTE: invoking MPI_ABORT causes Open MPI to kill all MPI processes. You may or may not see output from other p...

Hello, I've already drop to build packages ... and now it configures and makes fine, but when I try to run some calculations I've got: [mm@c100 abinit]$ /usr/lib64/openmpi-icc/bin/mpiexec -np 2 abinit < tparal_1.files -------------------------------------------------------------------------- MPI_ABO...

Hello,

Thank you for the answer.
I've removed libxc but still have the same error.
Any other ideas what could be wrong?

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Mixer

Hello, I try to build abinit with libxc but it fails. I think the reason is trivial but I can't spot it :/ My configuration is (that's the part of spec): %configure CC=mpicc FC=mpif90 CXX=mpiCC \ --enable-mpi=yes \ --enable-mpi-io=yes \ --with-linalg-flavor=mkl \ --enable-64bit-flags=yes \ --with-li...