[CP2K:290] Re: MM_KIND/QM_KIND atom type

Teodoro Laino teodor... at gmail.com
Fri Sep 21 16:02:24 UTC 2007

You need to specify COMMENSURATE in MGRID section..

I will put a check that will stop with an error in case someone  
forgets this keyword for QMMM runs..

On 21 Sep 2007, at 18:00, Luca wrote:

>     &MGRID
>       CUTOFF 140
>     &END MGRID

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