[CP2K-user] CP2K 7.1-Cuda Bandgap and HF energies different from previous versions
Fabian Ducry
fabia... at gmail.com
Mon May 4 16:23:50 UTC 2020
Dear Leopold,
This page gives detailes about the configuration of the HPC clusters used
in the tests: https://www.cp2k.org/performance:systems
But these test only compare the performance and do not check the accuracy
as far as I know. The dashboard (https://dashboard.cp2k.org/) states that
the current revision correctly runs on Piz Daint (psmp), at least according
to the regtests. Its possible that this aspect is not covered by any
regtest though.
Best,
Fabian
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