[CP2K-user] Thoughts on RDFs for NPT ensemble simulations?

[Ant]

Thank you very much indeed, Travis.  I have managed to get travis up and 
running and yes, the interactive method is very straightforward.  

I have not been able to make any progress with the CP2K method--there's no 
information anywhere on how to get it up and running by including cell 
volumes.  However, I'm happy to use travis.  Thank you very much for your 
help.
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