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. > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum > -- Dr. Axel Kohlmeyer akohlmey at gmail.com ?http://goo.gl/1wk0 College of Science and Technology Temple University, Philadelphia PA, USA.
