functional problem

[Rolf David]

More details.

Input would be a good start.

Did you try decreasing the EPS values ? Did your start from a BLYP 
converged WF ? 

If i recall correclty it's about the eq between KS et HF matrix in 
sparsity. It's somewhere in here.

On Tuesday, November 3, 2015 at 6:57:41 PM UTC+1, Rizwan Nabi wrote:
>
> Hi Samuel Andermatt 
>
>
> Sorry I could not understand what you want from the link.
>
> On Tuesday, November 3, 2015 at 6:33:38 PM UTC+5:30, Samuel Andermatt 
> wrote:
>>
>> Could you provide the information required by: 
>> http://www.cp2k.org/howto:gethelp
>>
>
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