CCL:G: average binding energy per atom

[Mikael Johansson <mikael.johansson*iki.fi>]

 Sent to CCL by: Mikael Johansson [mikael.johansson(!)iki.fi]
 Hello!
Yes, but it is of course highly dependent on the input file of the
 calculation that produced the output file. A good textbook on the topic
 followed by a look in the manual would make for an excellent holiday
 pastime, I think.
 Have a nice day,
     Mikael J.
     http://www.iki.fi/~mpjohans/
 On Fri, 17 Dec 2010, mohamed maatallah m.maatallah. .. .ucam.ac.ma wrote:
>  Sent to CCL by: "mohamed  maatallah" [m.maatallah++ucam.ac.ma]
>  Dear colleagues, is there a method to determine the values of:
>  The average binding energy per atom (Eb),
>  average binding energy,
>  vertical electron affinity (EA),
>  values of vertical ionization potentials (IP),
>  the HOMO_LUMO gap (Gap),
> >  from a file out of DFT calculations performed on Gaussian 03 or 09?
>  best regards.>