It does not help to repeat the same question again. With this info, nobody can help.
Am 21.05.2011 09:44, schrieb Pooja Rana: > Respected Prof. Blaha and dear Wien2k users > > I am facing problem with lapw1 during scf of supercell in NaCl structure. > The error as: > lapw1.error > 'SELECT' - no energy limits found for L= 2 > 'SELECT' - E-bottom -200.00000 E-top -200.00000 > > I have tried all corrections in related files and also checked the > structure file, it is generated successfully without any error. I have > also done supercell calculations with zincblende structure, without any > such type of error. > > Please guide my by your suggestions , how to rectify the problem. > > Many thanks > > with kind regards, > /Pooja Rana > // > / > > > > _______________________________________________ > 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 +43-1-5880115671
