[CP2K-user] CDFT Tutorial Zn- Zn+

[mejdeddine mokhtar]

I try to run the script for the Zn - Zn+ in the tutorial but I did not get 
the full output files as mentioned in the tutorial. Please notice that I 
use cp2k 5.1 installed locally. I was wondering what command line needed to 
run this script (I've tried ./energy.bash )?  I'd also plot the curve 
showing how the energy varies according to the interatomic distance.  I 
wonder if the script was running for just a particular distance? or for 
different distances?         
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