[Wien] [SPAM?] question of dstart
孙立忠
lzsun at mail.sitp.ac.cn
Sat Nov 8 14:46:23 CET 2003
dear wien2k user:
i am calculating of a 16 atoms cluster of GaAs. the super cell i have chosen as p1 and lattice constant is 20 angstroms and put that 16 atoms cluster in the center of the super cell.
when i run x dstart -c it consum so much time say 24 hours. but the gaas.clmsum file have some thing wrong likes below:
NUMBER OF PW******
then run lapw0 it crshed and show below information:
Input/Output Error 148: Invalid character
In Procedure: main program
At Line: 394
Statement: Formatted READ
Unit: 8
Connected To: gaas.clmsum
Form: Formatted
Access: Sequential
Records Read : 156934
Records Written: 0
Current I/O Buffer:
NUMBER OF PW******
!
End of diagnostics
how can i deal with this ? any suggestion is welcome!
L.Z. Sun
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