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removed lower rank GAV rate-rule
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this rate rule was conficting with a more sensible training reaction
for the same node, so it was removed. This is described more in
RMG-databases issue ReactionMechanismGenerator#199
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goldmanm committed Jul 19, 2017
1 parent f528cc2 commit 6864fc2
Showing 1 changed file with 0 additions and 15 deletions.
15 changes: 0 additions & 15 deletions input/kinetics/families/R_Addition_MultipleBond/rules.py
Original file line number Diff line number Diff line change
Expand Up @@ -66,21 +66,6 @@
shortDesc = u"""Aaron Vandeputte GAVs CBS-QB3""",
)

entry(
index = 5,
label = "Cds-HH_Cds-HH;CsJ-CdHH",
kinetics = ArrheniusEP(
A = (22100, 'cm^3/(mol*s)'),
n = 2.41,
alpha = 0,
E0 = (11.92, 'kcal/mol'),
Tmin = (300, 'K'),
Tmax = (1500, 'K'),
),
rank = 4,
shortDesc = u"""Aaron Vandeputte GAVs CBS-QB3""",
)

entry(
index = 6,
label = "Cds-HH_Cds-HH;CsJ-CdCsH",
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