> Am 10.04.2018 um 13:37 schrieb Noam Bernstein <noam.bernst...@nrl.navy.mil>:
>> On Apr 10, 2018, at 4:20 AM, Reuti <re...@staff.uni-marburg.de> wrote:
>>> Am 10.04.2018 um 01:04 schrieb Noam Bernstein <noam.bernst...@nrl.navy.mil>:
>>>> On Apr 9, 2018, at 6:36 PM, George Bosilca <bosi...@icl.utk.edu> wrote:
>>>> I have few questions for you. According to your original email you are
>>>> using OMPI 3.0.1 (but the hang can also be reproduced with the 3.0.0).
>>>> Also according to your stacktrace I assume it is an x86_64, compiled with
>>> x86_64, yes, but, gcc + ifort. I can test with gcc+gfortran if that’s
>> Was there any reason not to choose icc + ifort?
> For historical reasons, we only bought ifort, not the complete compiler
> suite. But VASP is 99% fortran, so I doubt it makes a difference in this
I see. Sure it's nothing which would change the behavior of VASP, but maybe the
interplay with Open MPI compiled with gcc. I try in my compilations to stay
with one vendor, being it GCC, PGI or Intel.
Looks like icc/icpc is freely available now:
Choosing Linux + Linux as platform to develop and execute seems to be the full
icc/icpc incl. the MKL (except the Fortran libs and scaLAPACK – but both are
freely available in another package). Only point to take care of, is the
location intel/system_studio_2018 where the usual compiler directories are
located and not one level above.
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