[Wien] error during DOS calculation

, -- Shamik Chakrabarti Research Scholar Dept. of Physics Meteorology Material Processing Solid State Ionics Lab IIT Kharagpur Kharagpur 721302 INDIA -- next part -- An HTML attachment was scrubbed... URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20110605

[Wien] error during DOS calculation

Did you try to repeat part of the calculations ? x lapw1 -up x lapw1 -dn x lapw2 -up -qtl x lapw2 -dn -qtl Am 05.06.2011 06:56, schrieb shamik chakrabarti: Dear wien2k users, We have written about this problem before. We are still facing the error. Any help in

[Wien] error during DOS calculation

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