[CP2K-user] [CP2K:21422] optimization of slab+molecule

[Viktor Yu. Kovalskii]

Good day, Sihem AZIZI!
Just remove this line from your input file:

  ADDED_MOS 10


Or don't use OT.

Best Regards,
Viktor Yu. Kovalskii
vityokster at gmail.com

вт, 29 апр. 2025 г., 11:35 Sihem AZIZI <sihemazizi85 at gmail.com>:

> Dear all,
> I'm trying to optimize a slab of 3 layers of Ru(111) with an H2 molecule,
> and I'm getting this error message: OT with ADDED_MOS/=0 not implemented
>
>    -
>
>
>    <https://apis.mail.yahoo.com/ws/v3/mailboxes/@.id==VjN-WNEkOlpYcbeIoN598-v_gXvzPF78LdrEi3XAw6TNV_FathlYpk3ParzPn0pUi_dXThvOwSf3J2bcSTBQuCztSw/messages/@.id==APTX1fFSUAA-aA-4SA6WYA4fDNU/content/parts/@.id==2/refresh?appid=YMailNorrin&ymreqid=925db7dc-ea70-572f-1cf3-480021010300>
>
> . Can you help me? Thanks in advance.
>
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