Sorry, I did not notice that you included the version. "touch .lcore" should help.
--- Professor Laurence Marks Department of Materials Science and Engineering Northwestern University www.numis.northwestern.edu "Research is to see what everybody else has seen, and to think what nobody else has thought" Albert Szent-Györgyi On Sun, Jan 22, 2023, 18:13 Laurence Marks <laurence.ma...@gmail.com> wrote: > Which Wien2k & mixer version are you using? > > Doing "touch .lcore" may work. I would compare the results. > > --- > Professor Laurence Marks > Department of Materials Science and Engineering > Northwestern University > www.numis.northwestern.edu > "Research is to see what everybody else has seen, and to think what nobody > else has thought" Albert Szent-Györgyi > > On Sun, Jan 22, 2023, 16:21 Wahid Kamal <kamal.wah...@gmail.com> wrote: > >> Hi, >> I wanted to use the method described by G. Madsen and P. Novak to >> estimate Hubbard term, but after changing case.incup/dn the calculation >> stops with "NEC01 charge leakage too large" error (using WIEN21) >> Using the old version of mixer (wien19), the calculation works without >> problem, it only happens with the new versions . How to correct this >> problem. >> Sincerely >> _______________________________________________ >> Wien mailing list >> Wien@zeus.theochem.tuwien.ac.at >> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien >> SEARCH the MAILING-LIST at: >> http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html >> >
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