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IV stop
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Topic: IV stop (Read 537 times)
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Jahanzaib
QuantumATK Guru
Posts: 112
Country:
Reputation: 3
IV stop
«
on:
January 11, 2025, 00:19 »
Hello Expert,
I want to re run my IV job as it stops, I have gone throught this (
https://docs.quantumatk.com/tutorials/restarting_calculations/restarting_calculations.html
) but in my case, I calculated the TS, then give path to TS and then calculated IV curve? Is there a other way to rerun from the last step?
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Anders Blom
QuantumATK Staff
Supreme QuantumATK Wizard
Posts: 5609
Country:
Reputation: 107
Re: IV stop
«
Reply #1 on:
January 16, 2025, 02:43 »
If you are using the IVCharacteristics method, the script is restartable as-is. That is, just rerun the script, without modifications, and it will skip all tasks already done.
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IV stop