Re: [Gausssum-devel] Turbomole and CD spectra

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

2009/8/18 Jonas Baltrusaitis <jas...@ya...>:
> I must say I was absolutely shocked when I found gaussum. I've been looking for something similar for several years now. It's quite incredible

If you have any suggestions how to better advertise, let me hear.

> I decided to bypass feature request and write directly to the devel
>
> I would like to ask to implement Turbomole support. I would be glad to contribute output files

That would be great. The real place for this development is over at
cclib.sf.net, which handles the parsing. Why not get over to cclib and
introduce yourself? If interested in writing some code, even better
:-)

> Another thing: if excited states can be done, why not add CD spectra?
>
> thanks
>
> JOnas
>
>
>
>
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