Dear Tran, Thank you so much. It is working now.
On Sat, Dec 21, 2013 at 11:30 PM, <t...@theochem.tuwien.ac.at> wrote: > At the beginning of the initiatlization (init_lapw) you are asked to > enter a reduction in %. Choose a larger value than you did before. > > More informations here: > http://www.wien2k.at/reg_user/textbooks/usersguide.pdf > > > On Sat, 21 Dec 2013, Muhammad Sajjad wrote: > > Dear Tran, >> Thank you so much for your kind response. Please let me know in which >> file i can do the mentioned job? I mean how can i choose smaller spheres >> readii? >> >> >> True Regards >> Sajjad >> >> >> On Sat, Dec 21, 2013 at 10:16 PM, <t...@theochem.tuwien.ac.at> wrote: >> This is because the atomic spheres overlap. So, you have to choose >> smaller >> spheres radii. >> >> On Sun, 22 Dec 2013, Muhammad Sajjad wrote: >> >> Dear all >> I am running optimization with wien2k 12 version. I am facing >> the following error >> >> >> ERROR status in OPTF123_vol__-5.0 >> > stop error >> >> NN - Error >> LAPW0 Kindlyhelp me to solve this propblem. >> >> Kind Regards >> >> >> _______________________________________________ >> 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 >> >> >> >> > _______________________________________________ > 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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