Parallel CP2K installation using MKL
Andreas Glöss
andreas... at gmail.com
Fri Apr 1 07:24:15 UTC 2016
Hi Kwon,
Sorry, but your post isn't understandable - so I guess what your questions
are.
Your benchmark results are correct and, depending on the hardware behind,
also the timings look reasonable.
>From the header of a calculation-output one can extract all important data
about the version, compile time, .... See:
CP2K| version string: CP2K version 2.6.2
CP2K| source code revision number: svn:15893
CP2K| is freely available from http://www.cp2k.org/
CP2K| Program compiled at Fri Apr 1 10:17:36 KST 2016
CP2K| Program compiled on eagle
CP2K| Program compiled for Linux-x86-64-intel
Please go on now with a full regression test to ensure numerical
correctness for all tests - the steps are described in the link of my last
post.
If you are unsure on how to interpret the results, just attach the
regression-test output in your next post.
Best regards,
Andreas
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