[CP2K-user] [CP2K:10924] Re: "CPASSERT failed"---kpoint calculations/band structure with hybrid functional PBE0?

[wuli... at gmail.com]

Dear Zhendong,
Thank you. It seems  that K-point sampling is not available for hybrid 
functionals.

Bests,
Lina

在 2018年11月10日星期六 UTC+8下午2:42:17，Zhendong Guo写道：
>
> Dear Lina
>   Please try a smaller  EPS_PGF_ORB   for instance, 1.0E-50
> Best regards
> zhendong
>
> On Sat, Nov 10, 2018 at 3:59 AM <wul... at gmail.com <javascript:>> wrote:
>
>> The cp2k version is 5.1, SVN source code revision svn: 18091
>>
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>
> -- 
> Zhendong Guo 
> Phone: +41786943316
> Email:  zhend... at gmail.com <javascript:>
>             zhen... at epfl.ch <javascript:>
> -------------------------------------------------------------------------------------------------
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