[Pw_forum] Kohn-Sham orbitals cube file, pp.x, output: 6

[nazari at iasbs.ac.ir]

Dear All,
I wish to have a kohn-sham orbitals for different states in
cube format.  In  pp.x if  the output format 6 is chosen
the cube file will be produced but  the density is written in cube
format ( header of output: Cubfile created from PWScf
calculation, Total SCF Density). How can I obtain the kohen-sham orbitals
in cube file format.
Regards
Fariba Nazari
IASBS




> On Fri, Jun 29, 2012 at 11:14 AM,
<nazari at iasbs.ac.ir> wrote: 
> 
>> Dear All, 
>> Would you please let me know if it is possible that the
kohn-Sham 
>> orbitals is written in cube format. I mean I need
the PSI(r) in cube 
>> format   not density. 
>> regards 
>> Fariba Nazari 
>> IASBS 

> 
>