[Wien] IOT Trap___SCF error

Li yan-ling ylli at theory.issp.ac.cn
Sun Apr 8 09:09:55 CEST 2007


Dear wien2k_07 users,

  I am running wien version 07.2 on a machine of type SGI with
fortran compiler f90.
  The purpose of my calculations is to get the SCF of 2H-TaS2. That's no
problem for packsge wien2k_06.3.
  I run "run_lapw -p -i 100 -cc 0.0001" from command line. After several
minutes, I saw the informations on my computer screen as follows.

 STOP  LAPW1 END
 STOP
 STOP  LAPW1 END
 STOP
 STOP  LAPW1 END
 STOP
 STOP  LAPW1 END
 STOP
 STOP  LAPW1 END
 STOP
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
 STOP LAPW2 - FERMI; weighs written
 STOP
 STOP  LAPW2 END
 STOP
 STOP  LAPW2 END
 STOP
 STOP  LAPW2 END
 STOP
 STOP  LAPW2 END
 STOP
 STOP  LAPW2 END
 STOP
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
Illegal option -- w
Usage: grep [-E|-F][-c|-l|-q][-xhbnsviyC] -e pattern_list [-f
pattern_file] [file ...]
 STOP  SUMPARA END
 STOP
 STOP  SUMPARA END
 STOP
 STOP  CORE  END
 STOP

lib-4095 : UNRECOVERABLE library error

Encountered during a list-directed WRITE to unit 22
Fortran unit 22 is connected to a sequential formatted text file:
  "2H-TaS2.scf"
IOT Trap

[1]    Exit 9                 run_lapw -cc 0.0001 -i 100 -p

  The program stops at this point. This is the content of the error file
'mixer.error'.

>Error in MIXER

  This is the bottom of the 2T-TaSe.dayfile.
>   lcore       (15:11:48) 0.1u 0.0s 0:00 107% 0+0k 0+1io 0pf+0w
>   mixer       (15:11:49)  Note: k-list has changed
Abort (core dumped)
0.1u 0.0s 0:00 100% 0+0k 3+3io 0pf+0w
error: command   /disk1/issp/ylli/wien2k_07/mixer mixer.def   failed

>   stop error

  I have browsed the archives AND READ THE USERS GUIDE and the
FAQ pages Peter provides, but I couldn't solve my problem that way.
  Can you help me? Thanks a lot.

Yan-ling Li

=====================================================
Mr. Yanling Li
Address:
    Key Laboratory of Materials Physics,Institute
    of Solid State Physics, Chinese Academy of Sciences
    Hefei, Anhui P.O.Box 1129, 230031 P. R. China
Telephone:
    86-551-5591464 (Office);13856913136(mobile)
E-Mail:
    ylli at theory.issp.ac.cn; ylli at xznu.edu.cn






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