[CP2K-user] [CP2K:13904] RESTART
eluni... at gmail.com
Wed Sep 16 04:28:22 UTC 2020
The section for restart is not a subsection of DFT.
You have to put:
out of the force eval section (EXT_RESTART is at the same level of motion,
force_eval and global ).
Regards - Lucas Lodeiro
El mié., 16 sept. 2020 a las 0:15, lili wang (<15465... at qq.com>) escribió:
> Dear everyone
> I ran AIMD 4000 steps, but I want to run 5000 steps. I added EXT_RESTART
> to DFT in .inp, but the error is unknown subsection EXT_RESTART of section
> DFT, can anyone help me?
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