Hi to the FORUM Sorry about the former message, I didn't put it in context. I am compiling espresso 4.0 on a ppc64 linux cluster, and I have a well known problem about ZHPEV. I am able to generate a nice pw.x, that works fine for many things but not for the example25. Also, I had a 3.2.2 binary that was able to run LDA+U calculations, but it also fails with this example, as enter write_ns U( 1) = 0.0000 U( 2) = 0.0000 U( 3) = 0.0000 alpha( 1) = 0.0000 alpha( 2) = 0.0000 alpha( 3) = 0.0000 atom 3 Tr[ns(na)]= 6.0000000 ** On entry to ZHPEV parameter number 1 had an illegal value
Any help would be greatly apreciated. On Fri, May 16, 2008 at 5:34 PM, Lorenzo Paulatto <paulatto at sissa.it> wrote: > > On Fri, May 16, 2008 17:16, Lucas Fernandez Seivane wrote: >> I am trying to compile espresso 4.0 but I always fall with this >> problem. Do you have a make.sys for ppc970 + Linux? > > Dear Lucas, > which problem? > > regards > > -- > Lorenzo Paulatto > SISSA & DEMOCRITOS (Trieste) > +39 040 3787 511 > http://people.sissa.it/~paulatto/ > > > ---------------------------------------------------------------- > SISSA Webmail https://webmail.sissa.it/ > Powered by SquirrelMail http://www.squirrelmail.org/ > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum >
