[CP2K-user] [CP2K:17641] Restart job
Pedro R. Figueiredo
pedrorf93 at gmail.com
Fri Sep 9 15:50:51 UTC 2022
Dear all,
I am running some QMMM calculations with DFT. I am trying to restart a run
but it always fail with the following error:
CPASSERT failed
metadynamics_utils.F:767
===== Routine Calling Stack =====
5 restart_hills
4 hills
3 metadyn_forces
2 qs_mol_dyn_low
1 CP2K
I have added the restart section to my input but the problem persists:
*&EXT_RESTART RESTART_FILE_NAME METADYN-1.restart RESTART_COUNTERS
.FALSE.&END*
Do I need to add something to the HILLS section?
Thank you in advance!
Pedro
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