[CP2K-user] [CP2K:17649] Electron count?

[mdsimula...@gmail.com]

Thanks Thomas

What does it look like if the electron count is bad?

On Sunday, September 11, 2022 at 3:31:19 PM UTC-4 tkuehne wrote:

> Dear Frank, 
>
> grep for "density on regular grids“ in the output. 
>
> Best, 
> Thomas Kühne
>
> Am 11.09.2022 um 18:13 schrieb mdsimula... at gmail.com <
> mdsimula... at gmail.com>:
>
> Hello,
>
> I've seen a couple posts, such as this one: 
> https://groups.google.com/u/1/g/cp2k/c/Vr0B84q13lA/m/DjeexaQ_AAAJ
>
> that mentions the electron count...where do I find that information in the 
> output?
>
> Thanks,
> Frank
>
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> ==============================
> Thomas D. Kühne
> Dynamics of Condensed Matter
> Chair of Theoretical Chemistry
> University of Paderborn
> Warburger Str. 100
> D-33098 Paderborn
> Germany
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