A word of caution regarding Intel MPI 2019: They changed a lot of things under 
the hood, and we have seen lots of issues in our systems on relatively large 
jobs (1.5K+ MPI processes). Basically most collective algorithms don't make it 
through. We have seen that on 2 different InfiniBand systems, I am unsure about 
OmniPath, or about the underlying cause (maybe libfabric issues?), but with 
Intel MPI 2018 we haven't seen them.

Best,
Damian

On 07.01.19, 16:37, "[email protected] on behalf of Kenneth 
Hoste" <[email protected] on behalf of [email protected]> 
wrote:

    Dear EasyBuilders,

    By tradition at the start of the year, I have started looking at
    updating the 'foss' and 'intel' common toolchains, currently for the
    2019a update.
    The plan is to include these in the upcoming EasyBuild v3.8.1 release,
    which I hope to release in a couple of weeks.

    Current proposals are:

    * foss/2019a:
       (see https://github.com/easybuilders/easybuild-easyconfigs/pull/7371)

       - GCC 8.2.0 + binutils 2.31.1 [LATEST for both]

       - OpenMPI 3.1.3 (latest 3.x)

       - OpenBLAS 0.3.5 [LATEST]
         + ScaLAPACK 2.0.2 [LATEST]

        - FFTW 3.3.8 [LATEST]

        => There also is OpenMPI 4.0.0, but we generally stay away from new
    major version of a toolchain component for the common toolchains.

           Does anyone have a detailed view on how OpenMPI v4.0.0 compares
    to v3.1.3, and whether or not we should consider v4.0.0?


    * intel/2019a
       (see https://github.com/easybuilders/easybuild-easyconfigs/pull/7372)

       - Intel C/C++/Fortran compilers 2019.1.144  [LATEST]
         (a.k.a. 2019 update 1, a.k.a. 19.0.1.144 according to "icc -V")
         on top of GCC 8.2.0 + binutils 2.31.1

       - Intel MPI 2019.1.144 (a.k.a. 2019 update 1) [LATEST]

       - Intel MKL 2019.1.144 (a.k.a. 2019 update 1) [LATEST]

       => Any positive/negative experiences with the latest version of the
    Intel tools, or any remarks that may be relevant to the version we pick
    for intel/2019a?


    I'm currently testing these foss/2019a and intel/2019a proposals with a
    bunch of existing easyconfigs using the */2018b equivalent.

    A couple of minor compilation problems popped up when compiling with GCC
    8.2.0 (for HDF5, NASM, ...), but they were resolved trivially by simply
    updating to the latest version of these dependencies.


    The 2019a toolchain definitions will also be discussed during the
    EasyBuild conf call this Wednesday (Jan 9th).



    regards,

    Kenneth




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Forschungszentrum Juelich GmbH
52425 Juelich
Sitz der Gesellschaft: Juelich
Eingetragen im Handelsregister des Amtsgerichts Dueren Nr. HR B 3498
Vorsitzender des Aufsichtsrats: MinDir Dr. Karl Eugen Huthmacher
Geschaeftsfuehrung: Prof. Dr.-Ing. Wolfgang Marquardt (Vorsitzender),
Karsten Beneke (stellv. Vorsitzender), Prof. Dr.-Ing. Harald Bolt,
Prof. Dr. Sebastian M. Schmidt
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