Geometry Optimization getting stuck after 9 steps

Yingchun Zhang zhangyin... at
Sun Jul 8 05:01:45 UTC 2018

Hi Aniruddha,

This problem may also be related to your MPI and MKL.  Try to submit your 
job again, see if it works. If so, try to compile CP2K with different 
version of MPI and MKL.

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