[DFTB-Plus-User] OpenMP compilation ?
Michal Husak
Michal.Husak at vscht.cz
Fri May 20 16:24:08 CEST 2022
Hi
>In order to prevent unwanted disasters during testing (where people
>tend to start several tests in parallel via the '-j' option), the
>test environment is set up to use one thread only. However, this you
>can tune via the -DTEST_OMP_THREADS option, if you whish, when
>configuring the project. See the "Testing DFTB+" section in INSTALL.rst.
I had find the sequence in manual:
set up the ``TEST_OMP_THREADS`` variable to ``2`` (in `config.cmake`), issue
The test output files already detects 4 threads after modification of
the TEST_OMP_THREADS to 4:
OpenMP threads: 4
And dftb+.exe occasionally indicate more than 25% CPU load (4 core
machine) ...
So it looks like it works
Thanks ...
Michal
More information about the DFTB-Plus-User
mailing list