[CP2K:1642] generic error message

[Laino Teodoro]

Thanks Ondrej,

It's important to address these errors (generic) in order to  
substitute them into
something more user friendly/understandable.
Thanks again.
Teo

On 15 Dec 2008, at 18:29, Ondrej Marsalek wrote:

>
> hi,
>
> i have met one of those generic "condition failed" error messages. if
> i remember correctly, teo wanted to have these reported. so...
>
> by mistake, i have turned off orbital rotation for a roks calculation.
> in the output, it says:
>
>  *
>  *** 18:21:24 ERRORL2 in qs_scf:init_scf_loop processor      0   
> err=-300   ***
>  *** condition FAILED at line  
> 1561                                         ***
>  *
>
> going to the appropriate place confirms that the cause is indeed the
> need for orbital rotation with a restricted calculation.
>
> i don't consider this a problem. as i said, i only report it because
> it was asked for. perhaps teo or someone else would like to replace it
> with a more specific message.
>
> cp2k version as reported in the output:
> CP2K| Last CVS entry              topology_amber.F/1.7/Sun Nov  9  
> 01:01:02 2008
>
> cheers,
> ondrej
>
> >