Hi, No, I dont think that would be the case.I am trying to do something similar to the example 10 in the manual but with different structure,so I first perform scf and then read data from there to perform the berry phase nscf run. I dont think that the version are different.
On Thu, Jun 2, 2011 at 3:11 PM, Paolo Giannozzi <giannozz at democritos.it>wrote: > > On Jun 2, 2011, at 20:17 , swapnil chandratre wrote: > > > I receive the following error, when I run the nscf script > > "nscf script"? > > > after completing the scf run. > > [...] > > # Dat not found > > name=NON-PERIODIC_CELL_CORRECTION > > are you rtying to restart from a data file written by a previous > version of the code? > > P. > --- > Paolo Giannozzi, Dept of Chemistry&Physics&Environment, > Univ. Udine, via delle Scienze 208, 33100 Udine, Italy > Phone +39-0432-558216, fax +39-0432-558222 > > > > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum > -- Regards, Swapnil Chandratre Graduate Student Dept. of Mechanical Engineering, University of Houston, Houston, TX (M)-713-294-9546 -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110602/635c9379/attachment-0001.htm
