[CP2K-user] How get squared MO-cubes?

[Travis]

Hi,

Modify the subtraction routine in cubecruncher to * instead of -. Recompile.

cube1%grid=cube1%grid-cube2%grid 

to

cube1%grid=cube1%grid*cube2%grid

 -T

On Wednesday, October 14, 2020 at 3:32:02 PM UTC-4 Lucas Lodeiro wrote:

> Hi all,
>
> I compile cubecruncher, but I cannot find the way to get the density 
> probability of MO-cube... cubecrunches enables to subtract or multiply by a 
> given factor the different cubes... but not multiply a cube by itself.
> I need to obtain MO-density profiles, but only I can get is the 
> MO-amplitude probability profile.
> There is a simple way to obtain this?
>
> Regards
>
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