[CP2K-user] How to get the SCF congvergence and MD step in real time in CP2K scripts

Zhiyin Gan ganz... at gmail.com
Mon Dec 30 07:21:18 UTC 2019

Dear all :

I hope  to read the actual  SCF convergence and MD step in real time in my 
scripts  to control the calculation flows, Could anyone help me to realize 
it ? 

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