[CP2K-user] Error While Doing Band Structure Exercise 2017

Fabian Ducry fabia... at gmail.com
Mon Apr 27 16:12:49 UTC 2020


Dear Rakesh,

There could be a number of sources for this problem. We will need more 
information to solve it.
Did you compile cp2k yourself? If so, have you tested the the executable (
https://www.cp2k.org/dev:regtesting)?
Does it work without mpi parallelization?

Best,
Fabian
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