[CP2K-user] Generating average electrostatic potential along Y axis

Aniruddha Dive anirud... at gmail.com
Tue May 7 23:55:03 UTC 2019


I am trying to generate average electrostatic potential plots using the 
V_HARTREE_CUBE command. However I would like to know how I generate the 
average electrostatic potential along only the Y axis.

I am using below commands to generate electrostatic potential files:


Does defining STRIDE 0 2 0 calculates the electrostatic potentials along 
the Y axis??

Also, how I plot the ***-v_hartree-1_0.cube files to generate the 
electrostatic potential vs distance along Y axis curves?

Aniruddha M Dive
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20190507/f6bfa491/attachment.htm>

More information about the CP2K-user mailing list