[Pw_forum] help on convergence

[Axel Kohlmeyer]

On Sun, Apr 8, 2012 at 9:08 AM, bamidele ibrahim
<bamideleibrahim at yahoo.com> wrote:
> Dear all,
>  I am working on TiO2 and running scf for this compound, i have not been
> able to get a convergence. I will be delighted if i can get help on this
> from any expert. I have with this mail the input file for the scf.

this input aborts with an error message.

axel.


>
> Adetunji Bamidele Ibrahim(PhD Student)
> Department of physics,University of Agriculture,
> Abeokuta, Ogun State,Nigeria.
>
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-- 
Dr. Axel Kohlmeyer
akohlmey at gmail.com  http://goo.gl/1wk0

College of Science and Technology
Temple University, Philadelphia PA, USA.