Respected Prof. Blaha and Dear Wien2k users,
Presently i am working with NaCl structure. During the initialisation of the structure it stops on x dstart with showing an error given below: Error, structure doesnot appear to have variable positions! Pairhess - Error. check file pairhess.error. 0.001u 0.004s 0:00.00 0.0% 0+0k 0+0io 0pf+0w In order to solve the above mentioned problem , we have check dstart.error file in our subdirectory but unable to find the solution. Kindly help me by suggesting me the approperiate way to solve the problem. with thanks and kind regards, Pooja Rana Research Scholar Condensed Matter Theory Group School of Studies In Physics Jiwaji University, GWALIOR - 474011 (M.P.), INDIA -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20110416/96e555c9/attachment-0001.htm>