[CP2K-user] [CP2K:17912] Re: Geometry optimization input

[Matt Watkins]

Sorry, what have you tried that does not work?
If anything doesn't work or at least seem to improve after a few tens of 
steps you might want to check if it makes sense.
Matt

On Wednesday, 19 October 2022 at 13:38:41 UTC+1 sc131... at gmail.com wrote:

> Hi all,
>
> Can anyone provide geometry optimization input with Kpoints. With the 
> input on cp2k.org, I am unable to converge scf even after 1000 steps. 
>
> Many thanks! 
> Sweta
>

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