The ABINIT Users Mailing List ( CLOSED )

[Xavier Gonze <gonze@pcpm.ucl.ac.be>]

Dear Vinayak,

When it was released, version 4.5.2 was advertised to be for  
developers only. For several
month, it is available only for reference, see the Web site. Current  
preferred production
version is v4.6.5.
Could you switch to v4.6.5 ? If the problem shows up again, send  
again your mail ...

Xavier Gonze

On 12 Apr 2006, at 06:14, vinayak@ipr.res.in wrote:

> Regarding the ABINIT code, we wanted to get your comments on some  
> of the
> runtime issues
> Dear ABINIT users
>
> I'm trying to use the 4.5.2 version of the code.
> Code was compiled using pgif90 compiler. But at the runtime the  
> jobs are
> getting launched fine and after sometime it throws the error as below
>
>  pspatm: epsatm=    0.06052049
>          --- l  ekb(1:nproj) -->
>              0   -6.173171
>              1  -23.886063
>              3   -5.121104
>  pspatm: atomic psp has been read  and splines computed
>
> 0: DEALLOCATE: memory at 0x7e979c0 not allocated
> 0: DEALLOCATE: memory at 0x7e979e0 not allocated
> 0: DEALLOCATE: memory at 0x7f06280 not allocated
> 0: DEALLOCATE: memory at 0x7f06260 not allocated
> 0: DEALLOCATE: memory at 0x7f06260 not allocated
> 0: DEALLOCATE: memory at 0x7f06270 not allocated
> 0: DEALLOCATE: memory at 0x7f06290 not allocated
>
> This error comes only if we try to deallocate something which is not
> allocated. I am wondering, whether the ABINIT code is complete (any  
> patch
> is required).. or have you ever faced similar problems.. any available
> work around for this. This sounds like we have to identify the
> corresponding deallocates in the code and eliminate those.
> Let me know your comments on that.
>
> regards
> vinayak
> vinayak@ipr.res.in