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ReactionMechanismGenerator / ReactionMechanismSimulator.jl Public

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Deadend radical algorithm RMG-RMS twin PR#203

Merged

mjohnson541 merged 6 commits intomainReactionMechanismGenerator/ReactionMechanismSimulator.jl:mainfrom

deadend_radicalReactionMechanismGenerator/ReactionMechanismSimulator.jl:deadend_radicalCopy head branch name to clipboard

May 16, 2023

Conversation Commits6 (6)Checks Files changed

Merged

Deadend radical algorithm RMG-RMS twin PR#203
mjohnson541 merged 6 commits intomainfrom
deadend_radical

Commits

Commits on Apr 18, 2023

Calculate core species net consumption rates & core radical net termination rates
hwpang
committed
Calculate the ratio of net consumption/termination of core radicals contributed by each edge reaction compared to all core reactions
hwpang
committed
feed in deadendradicaltolerance
hwpang
committed
output corespeciesnetconsumptionrates, coreradicalnetterminationrates
hwpang
committed
use deadend radical algorithm to identify objects
hwpang
committed
Add deadendradicaltolerance to test
hwpang
committed

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