Dear All Please help me how to solve this problem Error in LAPW1 'SELECT' - no energy limits found for atom 1 L= 0 'SELECT' - E-bottom -200.00000 E-top -200.00000 with regards sikander -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20140715/0e1501be/attachment.htm>