The ABINIT Users Mailing List ( CLOSED )

[roman.breiter@uvt.uni-erlangen.de]

I am trying to optimize an organic structure.
abinit 4.1.3 (and 4.2.3, both ifc versions) break at line 276 in bonds.f with 
the message:
----------------------------------------
Input/Output Error 169: Output file capacity exceeded
   In Procedure: bonds
        At Line: 276
      Statement: Formatted WRITE
           Unit: Internal File
  Record Number: 1
End of diagnostics
------------------------------
I tested it, and its really this line! The internal file is 'message'. As far 
as I understand it, this line should never been reached with the exception if 
there is a bug. 
Can anybody help please? What could I check or change? Are the circumstances 
known when it occurs?

I think there is a similar message reported: convergence difficulties and Bug 
report -- Tue, 24 Jun 2003 08:28:36

Thanks in advance
Roman