Hi, > %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% > from cdiaghg : error # 1933 > info =/= 0 > > %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Great! Now this message is reported N+1 times. Please read carefully the mail archive and troublshootings in the UserGuide (page 55: pw.x stops with error in cdiaghg or rdiaghg). Bests, Eyvaz. ------------------------------------------------------------------- Prof. Eyvaz Isaev, Theoretical Physics Department, Moscow State Institute of Steel & Alloys, Russia, Department of Physics, Chemistry, and Biology (IFM), Linkoping University, Sweden Condensed Matter Theory Group, Uppsala University, Sweden Eyvaz.Isaev at fysik.uu.se, isaev at ifm.liu.se, eyvaz_isaev at yahoo.com --- On Fri, 7/18/08, vega lew <vegalew at hotmail.com> wrote: > From: vega lew <vegalew at hotmail.com> > Subject: Re: [Pw_forum] something strange with my nscf and projwfc > calculations > To: "PWSCF Forum" <pw_forum at pwscf.org> > Date: Friday, July 18, 2008, 2:23 PM > Dear sir, > > OK, thank your for your reply. And sorry for my > precipitancy. > Last mail, Paolo Giannozzi just tell me a link have > something to do with the warning message. > But There was nothing about the cholesky decomposition > problem late reply of him. So I'm worry > about my expression on that matter. I think he didn't > note the problem. and I remind him there > was cholesky decomposition problem. I didn't mean to > hasten anyone. I'm sorry for the misunderstanding. > > Now I searched the acheive. and try to disable the parallel > of diagonalization using the commad > mpirun -hostfile ~/hostfile -np 20 pw.x -npools 2 -ndiag 1 > < input >output. > And there was another error like this, > > Band Structure Calculation > Davidson diagonalization with overlap > > > %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% > from cdiaghg : error # 1933 > info =/= 0 > > %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% > > stopping ... > > > Vega Lew > PH.D Candidate in Chemical Engineering > > State Key Laboratory of Materials-oriented Chemical > Engineering > College of Chemistry and Chemical Engineering > Nanjing University of Technology, 210009, Nanjing, Jiangsu, > China > > > > _________________________________________________________________ > Explore the seven wonders of the world > http://search.msn.com/results.aspx?q=7+wonders+world&mkt=en-US&form=QBRE_______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum
