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AssertionError during an RMG job run #2578

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PoojaNem opened this issue Nov 22, 2023 · 2 comments
Closed

AssertionError during an RMG job run #2578

PoojaNem opened this issue Nov 22, 2023 · 2 comments
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abandoned abandoned issue/PR as determined by actions bot stale stale issue/PR as determined by actions bot

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@PoojaNem
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An error message: assert spc.name not in phasesys.phases[phase_label].names, spc.name
AssertionError: C7H14-2

Context:
I am trying to generate chemical kinetic model for methylcyclohexane combustion with air using JetSurf2.0 mechanism included in the RMG database. Shortly after starting the simulation RMG throws an error (image attached below for the reference) with species C7H14-2.
image

Question:
Can someone help me understand what is this error and its source. I have verified JetSurf2.0 dictionary and it does include species C7H14-2. Also, is there any documentation available to understand commonly encountered errors in RMG?

@JacksonBurns
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Related to #2548

@hwpang could you comment?

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This issue is being automatically marked as stale because it has not received any interaction in the last 90 days. Please leave a comment if this is still a relevant issue, otherwise it will automatically be closed in 30 days.

@github-actions github-actions bot added the stale stale issue/PR as determined by actions bot label Mar 12, 2024
@github-actions github-actions bot added the abandoned abandoned issue/PR as determined by actions bot label Apr 11, 2024
@github-actions github-actions bot closed this as not planned Won't fix, can't repro, duplicate, stale Apr 11, 2024
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3 participants