On Sat, 17 Feb 2007, Ezad Shojaee wrote: ES> hi ES> how should i define the grid for phonon calculation, not to have " q not ES> allowed " error?
this has been discussed a _lot_ in this forum. please dig through the archives. thanks, axel. ES> thanx ES> ES> _________________________________________________________________ ES> FREE pop-up blocking with the new MSN Toolbar - get it now! ES> http://toolbar.msn.click-url.com/go/onm00200415ave/direct/01/ ES> ES> _______________________________________________ ES> Pw_forum mailing list ES> Pw_forum at pwscf.org ES> http://www.democritos.it/mailman/listinfo/pw_forum ES> -- ======================================================================= Axel Kohlmeyer akohlmey at cmm.chem.upenn.edu http://www.cmm.upenn.edu Center for Molecular Modeling -- University of Pennsylvania Department of Chemistry, 231 S.34th Street, Philadelphia, PA 19104-6323 tel: 1-215-898-1582, fax: 1-215-573-6233, office-tel: 1-215-898-5425 ======================================================================= If you make something idiot-proof, the universe creates a better idiot.
