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[echem] Updated CO2RR example input file - #2999

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JacksonBurns merged 1 commit into
ReactionMechanismGenerator:mainfrom
ssun30:CO2RR_example_clarifications
Aug 21, 2026
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[echem] Updated CO2RR example input file#2999
JacksonBurns merged 1 commit into
ReactionMechanismGenerator:mainfrom
ssun30:CO2RR_example_clarifications

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@ssun30

@ssun30 ssun30 commented Aug 21, 2026

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Motivation or Problem

The CO2RR example is intended to demonstrate electrochemical mechanism generation on an Ag111 surface. However, the data sources used by the example were not clearly documented, which could make it ambiguous whether the generated mechanism relies on Ag111-specific thermochemistry and kinetics data or on placeholder Pt111 libraries.

Description of Changes

Updated the CO2RR example input file and accompanying comments to clarify that Ag111-specific data are used for this example.

to clarify that Ag111 thermochemistry and kinetics
libraries are used specifically for this example.
@ssun30
ssun30 requested review from JacksonBurns and rwest August 21, 2026 15:53

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Thanks @ssun30 ! I am going to bypass and merge this now

@JacksonBurns
JacksonBurns merged commit 48e017c into ReactionMechanismGenerator:main Aug 21, 2026
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2 participants