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[ck2cti] Add support for sticking reactions

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This commit is contained in:
Ray Speth 2016-07-14 21:57:13 -04:00
parent ff3429faa9
commit cff277d350
1 changed files with 10 additions and 2 deletions
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12
interfaces/cython/cantera/ck2cti.py
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@ -466,9 +466,12 @@ class SurfaceArrhenius(Arrhenius):
def __init__(self, *args, **kwargs):
Arrhenius.__init__(self, *args, **kwargs)
self.coverages = []
self.is_sticking = False
def rateStr(self):
if not self.coverages:
if self.is_sticking:
return ' stick({0})'.format(Arrhenius.rateStr(self)[1:-1])
elif not self.coverages:
return ' ' + Arrhenius.rateStr(self)
s = Arrhenius.rateStr(self)
@ -1307,11 +1310,15 @@ class Parser(object):
# Note that the subsequent lines could be in any order
for line in lines[1:]:
tokens = line.split('/')
if 'stick' in line.lower():
arrhenius.is_sticking = True
if 'dup' in line.lower():
# Duplicate reaction
reaction.duplicate = True
elif 'low' in line.lower():
if 'low' in line.lower():
# Low-pressure-limit Arrhenius parameters for "falloff" reaction
tokens = tokens[1].split()
arrheniusLow = Arrhenius(
@ -1395,6 +1402,7 @@ class Parser(object):
falloff = Sri(A=A, B=B, C=C)
else:
falloff = Sri(A=A, B=B, C=C, D=D, E=E)
elif 'cov' in line.lower():
C = tokens[1].split()
arrhenius.coverages.append(