[Pw_forum] A problem about pdos

[Paolo Giannozzi]

On Dec 16, 2007, at 10:06 , oulihui666 wrote:

> However, when I calculated pdos, in order to produce a postscript  
> file:
> O2.pdos_tot, I encounter a problem, output is displayed as follows:
> ......
> k =  -0.3750000000 -0.2165063509  0.1678415576
>      e =   -30.88771 eV
>      psi =
>     |psi|^2 =   NaN

it works for me (both the 3.2.3 and the CVS versions)

Paolo
---
Paolo Giannozzi, Dept of Physics, University of Udine
via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222