11.09.2013 14:33, sikandar azam пишет:
I checked the the case.scfi and i have 28 eigen valves. And the number
of selected k-points 252. and dear sir Arshad i didn't run in the parallal.
Earlier there was Nk=251:
> >> number of k-points read in case.vector= 251
> >> forrtl: severe (174): SIGSEGV, segmentation fault occurred
> >> 0.279u 0.069s 0:00.51 64.7% 0+0k 0+0io 12pf+0w
> >> error: command /home/azam/WIEN2k111-lopw/spaghetti
> spaghetti.def failed
Maybe here is the problem?
Dear Sikander,
better send us more info: struct, klist (that was used for calculation),
insp, and scf1 files, and lapw1.error if it is nonzero.
Best wishes
Lyudmila Dobysheva
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