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Eon akmc moves not happening

Posted: Wed May 18, 2022 6:17 pm
by sanjay14kr
Hello,
I am running eon akmc simulations on the metallic system. Eon is predicting saddle points correctly but it is not making any akmc move. AKMC moves are being canceled and I get the following errors:
"Discarded results" and "canceled workunit" (Error image is attached)
Any help in solving this issue will be appreciated.
Regards,
Sanjay

Re: Eon akmc moves not happening

Posted: Wed May 18, 2022 9:08 pm
by graeme
In what you posted it looks like EON did a KMC step from state 0 to state 1.

See: "KMC step from state 0 through process 27 to state 1"

Re: Eon akmc moves not happening

Posted: Tue May 31, 2022 7:17 pm
by sanjay14kr
Thank you so much for your reply. Now, it is working fine.
Regards,
Sanjay