Re: [cclib-devel] What remains to be done

[Noel O'B. <bao...@gm...>]

I understand error to mean an error in cclib. "Not a correct
calculation" sounds like a problem with the log file, and should be a
warning.

On 03/09/07, Karol Langner <kar...@kn...> wrote:
> On Monday 03 September 2007 02:56, Noel O'Boyle wrote:
> > There's a Molpro regression failure for C_bigbasis_cart or something.
> I moved that from the data directory, becuase it was duplicating C_bigbasis,
> and it is not a correct calculation (augmented basis set in cartesian
> representation) which is why it has bogus output (stars in the mocoeffs
> because the cofficients are too large).
>
> I added an excpetion for this in the Molpro parser, which calls logger.error()
> with a message so that the parser doesn't crash. Now I see this gives alot of
> output when running the regressions, becuase the loglevel is set to ERROR.
> Should the loglevel be set lower, or should I issue a warning instead of an
> error to the logger in this case?
>
> Karol
>
> --
> written by Karol Langner
> Mon Sep  3 11:31:38 EDT 2007
>