[CP2K-user] Merge Cube files

[Matt W]

You can use cubecruncher utility, I think. There are other solutions 
(mainly python script) around to that are also recommended.

The STM keyword in the print section will allow you to calculate total 
charge density from the band gap up to or down to an energy range.

Matt

On Wednesday, August 28, 2019 at 2:37:01 PM UTC+1, Somil Gupta wrote:
>
> Hi all,
>
> Could you please tell me if it is possible to merge .cube files for 
> different MO's?
>
> The actual task is to obtain the entire charge density within a given 
> energy range.
>
> Thank you
> Somil
>
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