Make it 4 spaces. Also, check your case.inhf
The source of your problem is "obvious". Instead of having 496 electrons filling 248 up/dn states you have 96 filling 48 up/dn. All we can do is guess what you have done wrong. --- Professor Laurence Marks Department of Materials Science and Engineering Northwestern University http://www.numis.northwestern.edu Corrosion in 4D http://MURI4D.numis.northwestern.edu Co-Editor, Acta Cryst A "Research is to see what everybody else has seen, and to think what nobody else has thought" Albert Szent-Gyorgi On Sep 27, 2015 08:17, "Marzieh Gh" <mghoohestan...@gmail.com> wrote: > Dear Laurence Marks > <http://www.mail-archive.com/search?l=wien@zeus.theochem.tuwien.ac.at&q=from:%22Laurence+Marks%22> > > There are two spaces before the 496 in case.in2 > > > > -- > Marzieh Ghoohestani > PhD Student of Computational Nano Physics > Nano Research Center, Department of Physics > University of Technology, Isfahan, Iran > >
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