This type of problem has been reported many times before. While there is always the possibility that it is something in the mixer, in 99.9999% of cases it occurs because some other program/step in the scf iteration has failed. There are multiple possibilities: a) Something went wrong in lapw2, e.g. ghostbands b) Something went wrong in lapw1, e.g. no linearization energies found c) Something went wrong in lcore d) The case was run in a "dirty" directory, with case.*broyd* files left over from another run.
Save the run, and re-initialize cleanly accepting all defaults then try again. On Fri, Apr 24, 2020 at 4:20 AM Mohad Abbasnejad < mohaddeseh.abbasne...@gmail.com> wrote: > Dear experts, > > Hello every one. > Recently, I have installed WIEN2k_19 on my system using intel ifort > compiler 2013.5.192 and mkl. The program is compiled with the suggested > compiler options. > After running the scf calculations, I receive the following error in cycle > 5 without any file describing the error. > The following is what I got when the program is stopped. > > > stop error > > error: command /opt/install/WIEN2k_19.1/mixer mixer.def failed > 0.0u 0.0s 0:00.55 10.9% 0+0k 1792+1560io 1pf+0w > > mixer (04:56:54) Segmentation fault (core dumped) > > lcore (04:56:54) 0.0u 0.0s 0:00.02 100.0% 0+0k 0+1008io 0pf+0w > > Any help would be appreciated. > > Regards, > Mohaddeseh > > Mohaddeseh Abbasnejad, > Assistant Professor of Physics, > Faculty of Physics, > Shahid Bahonar University of Kerman, > Kerman, Iran > P.O. Box 76169-133 > Tel: +98 34 31322199 > Fax: +98 34 33257434 > Cellphone: +98 917 731 7514 > E-Mail: m.abbasne...@gmail.com > Website: academicstaff.uk.ac.ir/moabbasnejad > <https://urldefense.com/v3/__http://academicstaff.uk.ac.ir/moabbasnejad__;!!Dq0X2DkFhyF93HkjWTBQKhk!D3MRCkXjkXn9qoYtLfm2fNyZgEbrCf-orr33a9fSMt_Ne7ihdpjSIIVs7NXrdAbnhMTQiA$> > > _______________________________________________ > Wien mailing list > Wien@zeus.theochem.tuwien.ac.at > > https://urldefense.com/v3/__http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien__;!!Dq0X2DkFhyF93HkjWTBQKhk!D3MRCkXjkXn9qoYtLfm2fNyZgEbrCf-orr33a9fSMt_Ne7ihdpjSIIVs7NXrdAaFcYITEw$ > SEARCH the MAILING-LIST at: > https://urldefense.com/v3/__http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html__;!!Dq0X2DkFhyF93HkjWTBQKhk!D3MRCkXjkXn9qoYtLfm2fNyZgEbrCf-orr33a9fSMt_Ne7ihdpjSIIVs7NXrdAaU-xLqXQ$ > -- Professor Laurence Marks Department of Materials Science and Engineering Northwestern University www.numis.northwestern.edu Corrosion in 4D: www.numis.northwestern.edu/MURI Co-Editor, Acta Cryst A "Research is to see what everybody else has seen, and to think what nobody else has thought" Albert Szent-Gyorgi
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