[Wien] lapw2 problem on xeon mac
Michael Gurnett
michael.gurnett at kau.se
Mon Nov 13 23:50:48 CET 2006
I have compiled Wien2k on a mac (dual xeon dual core processors) on osx
using the latest wien2k, mkl and ifort. Eveything went fine with the
compilation (no errors). My inital tests with the bench mark gave 108
seconds for 2 threads and 92 seconds using 4 threads (-axT). However If
I run a case with more than 2 k points I get an error in lapw2. I
recompiled with -ftrapuv -C -traceback and got the following message
LAPW0 END
LAPW1 END
forrtl: severe (193): Run-Time Check Failure. The variable 'recpr_$GMIN' is being used without being defined
Image PC Routine Line Source
lapw2c 001746BF Unknown Unknown Unknown
lapw2c 00159F4D Unknown Unknown Unknown
lapw2c 0014416F Unknown Unknown Unknown
lapw2c 00128F71 Unknown Unknown Unknown
lapw2c 0010AC59 _recpr_ 218 recpr.f
lapw2c 00104EFA _recfil_ 106 recfil.f
lapw2c 000C7D41 _MAIN__ 207 lapw2_tmp_.F
lapw2c 00002608 Unknown Unknown Unknown
lapw2c 000025C2 Unknown Unknown Unknown
lapw2c 000024E9 Unknown Unknown Unknown
Unknown 00000002 Unknown Unknown Unknown
forrtl: error (76): IOT trap signal
Has anyone managed to get wien2k working fully under osx.
Thanks
Michael
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