Does the error occur only after several scf cycles? Always after the same number of cycles ?
Did you modify case.inm in some strange way ? Also: ls -als *.broy* Which files exist and what size do they have ?? Am 28.05.2011 15:50, schrieb mouhamed mahdi: > Dear Prof. Perer Blaha, > thank you for your help ; i 'v the same problem > >Do you have enough disk space ? > yes > >Otherwise: > > > rm *.broy* > > x mixer > > cat case.scfm >> case.scf > > runsp .... > i v done all what you ask me but it remains the same error: > stop error > > > In source file qmix7.F, at line number 258 > File name = Fe3ML-Ag3ML.broyd2009 unformatted, sequential access > record = 1 > PGFIO-F-219/unformatted read/unit=32/attempt to read/write past end of record. > > > > CORE END > CORE END > LAPW2 END > LAPW2 END > LAPW1 END > LAPW1 END > LAPW0 END > in cycle 17 ETEST: .000215000000000 CTEST: .00358471 > > PLEASE what can I do to this error ; and i m ready for any questions > > > > _______________________________________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien -- ----------------------------------------- Peter Blaha Inst. Materials Chemistry, TU Vienna Getreidemarkt 9, A-1060 Vienna, Austria Tel: +43-1-5880115671 Fax: +43-1-5880115698 email: pblaha at theochem.tuwien.ac.at -----------------------------------------