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 > > >