[CP2K-user] [CP2K:17678] cp2k V_XC_CUBE

[oandr...@gmail.com]

Dear Cp2k group, 

I am trying to print both Hartree and xc as cube files. 

I am using 

&V_XC_CUBE

STRIDE 2 2 2

&END V_XC_CUBE


&V_HARTREE_CUBE

STRIDE 2 2 2

&END V_HARTREE_CUBE


However, I only get the Hartree. cube file. I removed the V_HARTREE_CUBE 
section and left the V_XC_CUBE but I still get a file as Hartree and not 
the xc cube file.

is this correct? am I misunderstanding something? should I obtain two 
independent cube files for Hartree and xc.?

I was wondering if you could give me advice on this.

I am using cp2k 9.1 in daint, 


best, 


Andres Ortega-Guerrero


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