Dear qe users and developpers, i want do calculations with hybrid functionnal using qe 5.0.1 parallel version after 23 iterations and plot k, the job suddenly stops without any error
the last line in the output file is :? " the Fermi energy is??? 12.1994 ev" i can't say "out of memory" because i have 0.5 To in the scratch (where calculations will be done) and 5Go in the data? i use : ???? Parallel version (MPI), running on??? 32 processors ???? R & G space division:? proc/pool =?? 32 ?? ? 48 atoms (metal type) i do not understand what happens any suggestions? cheers ===================================================================== Sakhraoui Taoufik,Phd student Laboratoire de la Mati?re Condens?e & Nanosciences Facult? des sciences de Monastir Avenue de l'environnement 5019-Monastir,Tunisie tel. :(+216) 96 173 454 || 22 618 579 email :tsakhrawi at yahoo.com || tousak at hotmail.fr ===================================================================== -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140530/e8a359e2/attachment.html
