[molpro-user] The problem occurs in writew

[Kirk Peterson]

Looks to me like you ran out of scratch disk space.  Make sure that the environment variable TMPDIR is pointing towards a large amount of disk or specify the temporary file space on the command line, e.g.,   molpro -d /my_scratch_file_system  inputfile

-Kirk

On Apr 15, 2011, at 7:14 AM, gaosm09 wrote:

> dear molpro-user
>  
> when i calculate single point energy by rs2c method with no level shift I met the problem below
>  A level shift of 0.30 is applied.
>   ITER. STATE  ROOT     SQ.NORM     CORR.ENERGY   TOTAL ENERGY   ENERGY CHANGE       DEN1      VAR(S)    VAR(P)      TIME
>     1     1     1     1.05857448    -0.01757234  -201.23933053    -0.01757234    -0.39459995  0.59D-01  0.56D-01 20715.74
>  ERROR WRITING        32768 WORDS AT OFFSET  675524707. TO FILE 8  IMPLEMENTATION=df   FILE HANDLE=  1019  IERR=-62232
>  ? Error
>  ? I/O error
>  ? The problem occurs in writew
>  
> -----------------------------------------------------------------
> is this due to lack of disk space?  How can I avoid this error?
>  
>  
>  
>  
>  
> 2011-04-15
> gaosm09
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