Indeed - the serial diagonalization cases seem to be fine. Paolo, did you get the files I sent over yesterday? I think the list may have bounced them - but I had CC'd you on it.
Dave On Feb 12, 2009, at 2:54 AM, Paolo Giannozzi wrote: > > On Feb 12, 2009, at 9:20 , Lorenzo Paulatto wrote: > >> That subroutine is usually where error originated in the most >> remotes parts of the code finally emerge. There are dozens of >> possible errors that will not cause any apparent problem for a >> while, until the errors accumulate enough to break positive >> definiteness of the matrix. > > this is a different case: if the subspace diagonalization it works on > one processor, > it has to work on more that one processor as well > > Paolo > --- > Paolo Giannozzi, Democritos and University of Udine, Italy > > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum David E. Farrell Post-Doctoral Fellow Department of Materials Science and Engineering Northwestern University email: d-farrell2 at northwestern.edu -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20090212/5870eb29/attachment.htm
