[Wien] Failure in mini
Michael Gurnett
michael.gurnett at kau.se
Mon Aug 4 13:26:13 CEST 2003
I was running mini at was at the 9th scf cycle when after or during
lapw2c the following error occurred
Input/Output Error 148: Invalid character
In Procedure: outp
At Line: 181
Statement: Formatted READ
Unit: 1040
Connected To: ./Germanium.help070
Form: Formatted
Access: Sequential
Records Read : 105
Records Written: 0
Current I/O Buffer:
L= 2 97.06107 ********** 14692.603********************-13727.608
!
End of diagnostics
What is the cause behind this error. The charge distance did suddenly
increase the step before. I was running it with a mix of 0.2. The system
is a 50 atom slab using 10 k points.
Hope someone can help
Michael
More information about the Wien
mailing list