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Merge pull request #166 from ReactionMechanismGenerator/unimol_kineti…
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Unimol kinetics part2
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nyee authored Feb 24, 2017
2 parents f6d6d73 + cfd05a4 commit ca441b5
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2 changes: 2 additions & 0 deletions input/kinetics/families/1,2_shiftS/groups.py
Original file line number Diff line number Diff line change
Expand Up @@ -18,6 +18,8 @@
['LOSE_RADICAL', '*3', '1'],
])

boundaryAtoms = ["*1", "*3"]

entry(
index = 1,
label = "XSYJ",
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