[Wien] clmsum error!
Arin
anin1996 at gmail.com
Sun Aug 20 11:08:28 CEST 2006
Dear wien2k users:
Recently we updated our version to wiek2k_06. However, for a TiC structure,
after run_lapw , an error occurred at the second iteration:
----------------------------------------------------------------------------------
FORTRAN STOP LAPW0 END
FORTRAN STOP LAPW1 END
FORTRAN STOP LAPW2 END
FORTRAN STOP CORE END
FORTRAN STOP MIXER END
ec cc and fc_conv 0 1 1
in cycle 2 ETEST: 0 CTEST: 0
Input/Output Error 148: Invalid character
In Procedure: main program
At Line: 472
Statement: Formatted READ
Unit: 8
Connected To: TiC.clmsum
Form: Formatted
Access: Sequential
Records Read : 2023
Records Written: 0
Current I/O Buffer:
0 0
0????????????????????????????????????????????????????????????
!
End of diagnostics
-----------------------------------------------------------------------------------------
Then we checked the .clmsum file and found at line 2023, it is like this:
-----------------------------------------------------------------------------------------
0 0
0????????????????????????????????????????????????????????????
-1 -1
-1????????????????????????????????????????????????????????????
0 0
-2????????????????????????????????????????????????????????????
-----------------------------------------------------------------------------------------
That maybe the problem. We have another computer which installed with
wien2k_05 and has no poblem, so we changed our version to 05 but the same
error occurred again.
We don't know how to fix this error, and I found there were many clmsum
errors in former maillist but they didn't help.
Anyone can give a suggestion? I appreciate your help.
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