[CP2K-user] Restarting NORMAL_MODES calculations

Kacper Drużbicki kacper.... at gmail.com
Thu May 30 21:57:07 UTC 2019


Dear Community,

I am running frequency and intensities calculations for a 600 atomic unit 
cell, with a great number of NPROC_REP used. 

Can anybody instruct me if it is possible to restart such runs? Or 
alternatively, is it possible to do it for a single replica calculation? 

I face the wall clock limits and cannot find any information on this.

Thanks!
Kacper



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