diff --git a/test_problems/multiGasTransport/.cvsignore b/test_problems/multiGasTransport/.cvsignore
new file mode 100644
index 000000000..f9f3c166b
--- /dev/null
+++ b/test_problems/multiGasTransport/.cvsignore
@@ -0,0 +1,9 @@
+outputa.txt
+output.txt
+transport_log.xml
+diff_test.out
+csvCode.txt
+*.d
+multiGasTransport
+.depends
+Makefile
diff --git a/test_problems/multiGasTransport/Makefile.in b/test_problems/multiGasTransport/Makefile.in
new file mode 100644
index 000000000..3b1b80255
--- /dev/null
+++ b/test_problems/multiGasTransport/Makefile.in
@@ -0,0 +1,122 @@
+#!/bin/sh
+
+############################################################################
+#
+# Makefile to compile and link a C++ application to
+# Cantera.
+#
+#############################################################################
+
+# addition to suffixes
+.SUFFIXES : .d
+
+# the name of the executable program to be created
+PROG_NAME = multiGasTransport
+
+# the object files to be linked together. List those generated from Fortran
+# and from C/C++ separately
+OBJS = multiGasTransport.o
+
+# Location of the current build. Will assume that tests are run
+# in the source directory tree location
+src_dir_tree = 0
+
+# additional flags to be passed to the linker. If your program
+# requires other external libraries, put them here
+LINK_OPTIONS = @EXTRA_LINK@
+
+#############################################################################
+
+# Check to see whether we are in the msvc++ environment
+os_is_win = @OS_IS_WIN@
+
+# Fortran libraries
+FORT_LIBS = @FLIBS@
+
+# the C++ compiler
+CXX = @CXX@
+
+# C++ compile flags
+ifeq ($(src_dir_tree), 1)
+CXX_FLAGS = -DSRCDIRTREE @CXXFLAGS@
+else
+CXX_FLAGS = @CXXFLAGS@
+endif
+
+# Ending C++ linking libraries
+LCXX_END_LIBS = @LCXX_END_LIBS@
+
+# the directory where the Cantera libraries are located
+CANTERA_LIBDIR=@buildlib@
+
+# required Cantera libraries
+CANTERA_LIBS = @LOCAL_LIBS@ -lctcxx
+
+# the directory where Cantera include files may be found.
+ifeq ($(src_dir_tree), 1)
+CANTERA_INCDIR=../../Cantera/src
+else
+CANTERA_INCDIR=@ctroot@/build/include/cantera
+endif
+
+# flags passed to the C++ compiler/linker for the linking step
+LCXX_FLAGS = -L$(CANTERA_LIBDIR) @LOCAL_LIB_DIRS@ @CXXFLAGS@
+
+# How to compile C++ source files to object files
+.@CXX_EXT@.@OBJ_EXT@: Interface.h
+ $(CXX) -c $< -I$(CANTERA_INCDIR) @CXX_INCLUDES@ $(CXX_FLAGS)
+
+# How to compile the dependency file
+.cpp.d:
+ @CXX_DEPENDS@ -I$(CANTERA_INCDIR) $(CXX_FLAGS) $*.cpp > $*.d
+
+# List of dependency files to be created
+DEPENDS=$(OBJS:.o=.d)
+
+# Program Name
+PROGRAM = $(PROG_NAME)$(EXE_EXT)
+
+# all rule makes a single program
+all: $(PROGRAM)
+
+# Rule to make the program
+$(PROGRAM): $(OBJS) $(CANTERA_LIBDIR)/libctbase.a
+ $(CXX) -o $(PROGRAM) $(OBJS) $(LCXX_FLAGS) $(LINK_OPTIONS) \
+ $(CANTERA_LIBS) @LIBS@ $(FORT_LIBS) \
+ $(LCXX_END_LIBS)
+
+# Add an additional target for stability:
+$(OBJS): $(CANTERA_LIBDIR)/libctbase.a $(CANTERA_LIBDIR)/libthermo.a
+
+
+# depends target
+depends:
+ $(RM) *.d .depends
+ @MAKE@ .depends
+
+.depends: $(DEPENDS)
+ cat *.d > .depends
+
+# Do the test -> For the windows vc++ environment, we have to skip checking on
+# whether the program is uptodate, because we don't utilize make
+# in that environment to build programs.
+test:
+ifeq ($(os_is_win), 1)
+else
+ @ @MAKE@ -s $(PROGRAM)
+endif
+ @ ./runtest
+
+# clean target -> clean up
+clean:
+ $(RM) $(OBJS) $(PROGRAM) $(DEPENDS) .depends
+ ../../bin/rm_cvsignore
+ (if test -d SunWS_cache ; then \
+ $(RM) -rf SunWS_cache ; \
+ fi )
+
+ifeq ($(wildcard .depends), .depends)
+include .depends
+endif
+
+
diff --git a/test_problems/multiGasTransport/gri30.xml b/test_problems/multiGasTransport/gri30.xml
new file mode 100644
index 000000000..6acba138c
--- /dev/null
+++ b/test_problems/multiGasTransport/gri30.xml
@@ -0,0 +1,6173 @@
+
+
+
+
+
+
+ O H C N Ar
+
+ H2 H O O2 OH H2O HO2 H2O2 C CH
+ CH2 CH2(S) CH3 CH4 CO CO2 HCO CH2O CH2OH CH3O
+ CH3OH C2H C2H2 C2H3 C2H4 C2H5 C2H6 HCCO CH2CO HCCOH
+ N NH NH2 NH3 NNH NO NO2 N2O HNO CN
+ HCN H2CN HCNN HCNO HOCN HNCO NCO N2 AR C3H7
+ C3H8 CH2CHO CH3CHO
+
+
+ 300.0
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+ 1.300000E+02
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+ 5000.000000
+
+
+ CH3OH:1 O:1
+ CH3O:1 OH:1
+
+
+
+
+ O + C2H [=] CH + CO
+
+
+ 5.000000E+10
+ 0
+ 0.000000
+
+
+ C2H:1 O:1
+ CH:1 CO:1
+
+
+
+
+ O + C2H2 [=] H + HCCO
+
+
+ 1.350000E+04
+ 2
+ 1900.000000
+
+
+ C2H2:1 O:1
+ H:1 HCCO:1
+
+
+
+
+ O + C2H2 [=] OH + C2H
+
+
+ 4.600000E+16
+ -1.4099999999999999
+ 28950.000000
+
+
+ C2H2:1 O:1
+ C2H:1 OH:1
+
+
+
+
+ O + C2H2 [=] CO + CH2
+
+
+ 6.940000E+03
+ 2
+ 1900.000000
+
+
+ C2H2:1 O:1
+ CH2:1 CO:1
+
+
+
+
+ O + C2H3 [=] H + CH2CO
+
+
+ 3.000000E+10
+ 0
+ 0.000000
+
+
+ C2H3:1 O:1
+ H:1 CH2CO:1
+
+
+
+
+ O + C2H4 [=] CH3 + HCO
+
+
+ 1.250000E+04
+ 1.8300000000000001
+ 220.000000
+
+
+ C2H4:1 O:1
+ CH3:1 HCO:1
+
+
+
+
+ O + C2H5 [=] CH3 + CH2O
+
+
+ 2.240000E+10
+ 0
+ 0.000000
+
+
+ C2H5:1 O:1
+ CH2O:1 CH3:1
+
+
+
+
+ O + C2H6 [=] OH + C2H5
+
+
+ 8.980000E+04
+ 1.9199999999999999
+ 5690.000000
+
+
+ C2H6:1 O:1
+ C2H5:1 OH:1
+
+
+
+
+ O + HCCO [=] H + 2 CO
+
+
+ 1.000000E+11
+ 0
+ 0.000000
+
+
+ HCCO:1 O:1
+ H:1 CO:2
+
+
+
+
+ O + CH2CO [=] OH + HCCO
+
+
+ 1.000000E+10
+ 0
+ 8000.000000
+
+
+ CH2CO:1 O:1
+ HCCO:1 OH:1
+
+
+
+
+ O + CH2CO [=] CH2 + CO2
+
+
+ 1.750000E+09
+ 0
+ 1350.000000
+
+
+ CH2CO:1 O:1
+ CH2:1 CO2:1
+
+
+
+
+ O2 + CO [=] O + CO2
+
+
+ 2.500000E+09
+ 0
+ 47800.000000
+
+
+ CO:1 O2:1
+ CO2:1 O:1
+
+
+
+
+ O2 + CH2O [=] HO2 + HCO
+
+
+ 1.000000E+11
+ 0
+ 40000.000000
+
+
+ CH2O:1 O2:1
+ HO2:1 HCO:1
+
+
+
+
+ H + O2 + M [=] HO2 + M
+
+
+ 2.800000E+12
+ -0.85999999999999999
+ 0.000000
+
+ AR:0 C2H6:1.5 CO:0.75 CO2:1.5 H2O:0 N2:0 O2:0
+
+ H:1 O2:1
+ HO2:1
+
+
+
+
+ H + 2 O2 [=] HO2 + O2
+
+
+ 2.080000E+13
+ -1.24
+ 0.000000
+
+
+ H:1 O2:2
+ HO2:1 O2:1
+
+
+
+
+ H + O2 + H2O [=] HO2 + H2O
+
+
+ 1.126000E+13
+ -0.76000000000000001
+ 0.000000
+
+
+ H:1 H2O:1 O2:1
+ H2O:1 HO2:1
+
+
+
+
+ H + O2 + N2 [=] HO2 + N2
+
+
+ 2.600000E+13
+ -1.24
+ 0.000000
+
+
+ H:1 N2:1 O2:1
+ N2:1 HO2:1
+
+
+
+
+ H + O2 + AR [=] HO2 + AR
+
+
+ 7.000000E+11
+ -0.80000000000000004
+ 0.000000
+
+
+ H:1 AR:1 O2:1
+ AR:1 HO2:1
+
+
+
+
+ H + O2 [=] O + OH
+
+
+ 2.650000E+13
+ -0.67069999999999996
+ 17041.000000
+
+
+ H:1 O2:1
+ O:1 OH:1
+
+
+
+
+ 2 H + M [=] H2 + M
+
+
+ 1.000000E+12
+ -1
+ 0.000000
+
+ AR:0.63 C2H6:3 CH4:2 CO2:0 H2:0 H2O:0
+
+ H:2
+ H2:1
+
+
+
+
+ 2 H + H2 [=] 2 H2
+
+
+ 9.000000E+10
+ -0.59999999999999998
+ 0.000000
+
+
+ H2:1 H:2
+ H2:2
+
+
+
+
+ 2 H + H2O [=] H2 + H2O
+
+
+ 6.000000E+13
+ -1.25
+ 0.000000
+
+
+ H:2 H2O:1
+ H2:1 H2O:1
+
+
+
+
+ 2 H + CO2 [=] H2 + CO2
+
+
+ 5.500000E+14
+ -2
+ 0.000000
+
+
+ H:2 CO2:1
+ H2:1 CO2:1
+
+
+
+
+ H + OH + M [=] H2O + M
+
+
+ 2.200000E+16
+ -2
+ 0.000000
+
+ AR:0.38 C2H6:3 CH4:2 H2:0.73 H2O:3.65
+
+ H:1 OH:1
+ H2O:1
+
+
+
+
+ H + HO2 [=] O + H2O
+
+
+ 3.970000E+09
+ 0
+ 671.000000
+
+
+ H:1 HO2:1
+ H2O:1 O:1
+
+
+
+
+ H + HO2 [=] O2 + H2
+
+
+ 4.480000E+10
+ 0
+ 1068.000000
+
+
+ H:1 HO2:1
+ H2:1 O2:1
+
+
+
+
+ H + HO2 [=] 2 OH
+
+
+ 8.400000E+10
+ 0
+ 635.000000
+
+
+ H:1 HO2:1
+ OH:2
+
+
+
+
+ H + H2O2 [=] HO2 + H2
+
+
+ 1.210000E+04
+ 2
+ 5200.000000
+
+
+ H:1 H2O2:1
+ H2:1 HO2:1
+
+
+
+
+ H + H2O2 [=] OH + H2O
+
+
+ 1.000000E+10
+ 0
+ 3600.000000
+
+
+ H:1 H2O2:1
+ H2O:1 OH:1
+
+
+
+
+ H + CH [=] C + H2
+
+
+ 1.650000E+11
+ 0
+ 0.000000
+
+
+ H:1 CH:1
+ H2:1 C:1
+
+
+
+
+ H + CH2 (+ M) [=] CH3 (+ M)
+
+
+ 6.000000E+11
+ 0
+ 0.000000
+
+
+ 1.040000E+20
+ -2.7599999999999998
+ 1600.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.562 91 5836 8552
+
+ H:1 CH2:1
+ CH3:1
+
+
+
+
+ H + CH2(S) [=] CH + H2
+
+
+ 3.000000E+10
+ 0
+ 0.000000
+
+
+ H:1 CH2(S):1
+ H2:1 CH:1
+
+
+
+
+ H + CH3 (+ M) [=] CH4 (+ M)
+
+
+ 1.390000E+13
+ -0.53400000000000003
+ 536.000000
+
+
+ 2.620000E+27
+ -4.7599999999999998
+ 2440.000000
+
+ AR:0.7 C2H6:3 CH4:3 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.783 74 2941 6964
+
+ H:1 CH3:1
+ CH4:1
+
+
+
+
+ H + CH4 [=] CH3 + H2
+
+
+ 6.600000E+05
+ 1.6200000000000001
+ 10840.000000
+
+
+ H:1 CH4:1
+ H2:1 CH3:1
+
+
+
+
+ H + HCO (+ M) [=] CH2O (+ M)
+
+
+ 1.090000E+09
+ 0.47999999999999998
+ -260.000000
+
+
+ 2.470000E+18
+ -2.5699999999999998
+ 425.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.7824 271 2755 6570
+
+ H:1 HCO:1
+ CH2O:1
+
+
+
+
+ H + HCO [=] H2 + CO
+
+
+ 7.340000E+10
+ 0
+ 0.000000
+
+
+ H:1 HCO:1
+ H2:1 CO:1
+
+
+
+
+ H + CH2O (+ M) [=] CH2OH (+ M)
+
+
+ 5.400000E+08
+ 0.45400000000000001
+ 3600.000000
+
+
+ 1.270000E+26
+ -4.8200000000000003
+ 6530.000000
+
+ C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.7187 103 1291 4160
+
+ CH2O:1 H:1
+ CH2OH:1
+
+
+
+
+ H + CH2O (+ M) [=] CH3O (+ M)
+
+
+ 5.400000E+08
+ 0.45400000000000001
+ 2600.000000
+
+
+ 2.200000E+24
+ -4.7999999999999998
+ 5560.000000
+
+ C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.758 94 1555 4200
+
+ CH2O:1 H:1
+ CH3O:1
+
+
+
+
+ H + CH2O [=] HCO + H2
+
+
+ 5.740000E+04
+ 1.8999999999999999
+ 2742.000000
+
+
+ CH2O:1 H:1
+ H2:1 HCO:1
+
+
+
+
+ H + CH2OH (+ M) [=] CH3OH (+ M)
+
+
+ 1.055000E+09
+ 0.5
+ 86.000000
+
+
+ 4.360000E+25
+ -4.6500000000000004
+ 5080.000000
+
+ C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.6 100 90000 10000
+
+ H:1 CH2OH:1
+ CH3OH:1
+
+
+
+
+ H + CH2OH [=] H2 + CH2O
+
+
+ 2.000000E+10
+ 0
+ 0.000000
+
+
+ H:1 CH2OH:1
+ H2:1 CH2O:1
+
+
+
+
+ H + CH2OH [=] OH + CH3
+
+
+ 1.650000E+08
+ 0.65000000000000002
+ -284.000000
+
+
+ H:1 CH2OH:1
+ CH3:1 OH:1
+
+
+
+
+ H + CH2OH [=] CH2(S) + H2O
+
+
+ 3.280000E+10
+ -0.089999999999999997
+ 610.000000
+
+
+ H:1 CH2OH:1
+ CH2(S):1 H2O:1
+
+
+
+
+ H + CH3O (+ M) [=] CH3OH (+ M)
+
+
+ 2.430000E+09
+ 0.51500000000000001
+ 50.000000
+
+
+ 4.660000E+35
+ -7.4400000000000004
+ 14080.000000
+
+ C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.7 100 90000 10000
+
+ H:1 CH3O:1
+ CH3OH:1
+
+
+
+
+ H + CH3O [=] H + CH2OH
+
+
+ 4.150000E+04
+ 1.6299999999999999
+ 1924.000000
+
+
+ H:1 CH3O:1
+ H:1 CH2OH:1
+
+
+
+
+ H + CH3O [=] H2 + CH2O
+
+
+ 2.000000E+10
+ 0
+ 0.000000
+
+
+ H:1 CH3O:1
+ H2:1 CH2O:1
+
+
+
+
+ H + CH3O [=] OH + CH3
+
+
+ 1.500000E+09
+ 0.5
+ -110.000000
+
+
+ H:1 CH3O:1
+ CH3:1 OH:1
+
+
+
+
+ H + CH3O [=] CH2(S) + H2O
+
+
+ 2.620000E+11
+ -0.23000000000000001
+ 1070.000000
+
+
+ H:1 CH3O:1
+ CH2(S):1 H2O:1
+
+
+
+
+ H + CH3OH [=] CH2OH + H2
+
+
+ 1.700000E+04
+ 2.1000000000000001
+ 4870.000000
+
+
+ CH3OH:1 H:1
+ H2:1 CH2OH:1
+
+
+
+
+ H + CH3OH [=] CH3O + H2
+
+
+ 4.200000E+03
+ 2.1000000000000001
+ 4870.000000
+
+
+ CH3OH:1 H:1
+ H2:1 CH3O:1
+
+
+
+
+ H + C2H (+ M) [=] C2H2 (+ M)
+
+
+ 1.000000E+14
+ -1
+ 0.000000
+
+
+ 3.750000E+27
+ -4.7999999999999998
+ 1900.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.6464 132 1315 5566
+
+ H:1 C2H:1
+ C2H2:1
+
+
+
+
+ H + C2H2 (+ M) [=] C2H3 (+ M)
+
+
+ 5.600000E+09
+ 0
+ 2400.000000
+
+
+ 3.800000E+34
+ -7.2699999999999996
+ 7220.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.7507 98.5 1302 4167
+
+ H:1 C2H2:1
+ C2H3:1
+
+
+
+
+ H + C2H3 (+ M) [=] C2H4 (+ M)
+
+
+ 6.080000E+09
+ 0.27000000000000002
+ 280.000000
+
+
+ 1.400000E+24
+ -3.8599999999999999
+ 3320.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.782 207.5 2663 6095
+
+ H:1 C2H3:1
+ C2H4:1
+
+
+
+
+ H + C2H3 [=] H2 + C2H2
+
+
+ 3.000000E+10
+ 0
+ 0.000000
+
+
+ H:1 C2H3:1
+ H2:1 C2H2:1
+
+
+
+
+ H + C2H4 (+ M) [=] C2H5 (+ M)
+
+
+ 5.400000E+08
+ 0.45400000000000001
+ 1820.000000
+
+
+ 6.000000E+35
+ -7.6200000000000001
+ 6970.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.9753 210 984 4374
+
+ H:1 C2H4:1
+ C2H5:1
+
+
+
+
+ H + C2H4 [=] C2H3 + H2
+
+
+ 1.325000E+03
+ 2.5299999999999998
+ 12240.000000
+
+
+ H:1 C2H4:1
+ H2:1 C2H3:1
+
+
+
+
+ H + C2H5 (+ M) [=] C2H6 (+ M)
+
+
+ 5.210000E+14
+ -0.98999999999999999
+ 1580.000000
+
+
+ 1.990000E+35
+ -7.0800000000000001
+ 6685.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.8422 125 2219 6882
+
+ H:1 C2H5:1
+ C2H6:1
+
+
+
+
+ H + C2H5 [=] H2 + C2H4
+
+
+ 2.000000E+09
+ 0
+ 0.000000
+
+
+ H:1 C2H5:1
+ H2:1 C2H4:1
+
+
+
+
+ H + C2H6 [=] C2H5 + H2
+
+
+ 1.150000E+05
+ 1.8999999999999999
+ 7530.000000
+
+
+ H:1 C2H6:1
+ H2:1 C2H5:1
+
+
+
+
+ H + HCCO [=] CH2(S) + CO
+
+
+ 1.000000E+11
+ 0
+ 0.000000
+
+
+ H:1 HCCO:1
+ CH2(S):1 CO:1
+
+
+
+
+ H + CH2CO [=] HCCO + H2
+
+
+ 5.000000E+10
+ 0
+ 8000.000000
+
+
+ H:1 CH2CO:1
+ H2:1 HCCO:1
+
+
+
+
+ H + CH2CO [=] CH3 + CO
+
+
+ 1.130000E+10
+ 0
+ 3428.000000
+
+
+ H:1 CH2CO:1
+ CH3:1 CO:1
+
+
+
+
+ H + HCCOH [=] H + CH2CO
+
+
+ 1.000000E+10
+ 0
+ 0.000000
+
+
+ H:1 HCCOH:1
+ H:1 CH2CO:1
+
+
+
+
+ H2 + CO (+ M) [=] CH2O (+ M)
+
+
+ 4.300000E+04
+ 1.5
+ 79600.000000
+
+
+ 5.070000E+21
+ -3.4199999999999999
+ 84350.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.932 197 1540 10300
+
+ H2:1 CO:1
+ CH2O:1
+
+
+
+
+ OH + H2 [=] H + H2O
+
+
+ 2.160000E+05
+ 1.51
+ 3430.000000
+
+
+ H2:1 OH:1
+ H:1 H2O:1
+
+
+
+
+ 2 OH (+ M) [=] H2O2 (+ M)
+
+
+ 7.400000E+10
+ -0.37
+ 0.000000
+
+
+ 2.300000E+12
+ -0.90000000000000002
+ -1700.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.7346 94 1756 5182
+
+ OH:2
+ H2O2:1
+
+
+
+
+ 2 OH [=] O + H2O
+
+
+ 3.570000E+01
+ 2.3999999999999999
+ -2110.000000
+
+
+ OH:2
+ H2O:1 O:1
+
+
+
+
+ OH + HO2 [=] O2 + H2O
+
+
+ 1.450000E+10
+ 0
+ -500.000000
+
+
+ HO2:1 OH:1
+ H2O:1 O2:1
+
+
+
+
+ OH + H2O2 [=] HO2 + H2O
+
+
+ 2.000000E+09
+ 0
+ 427.000000
+
+
+ H2O2:1 OH:1
+ H2O:1 HO2:1
+
+
+
+
+ OH + H2O2 [=] HO2 + H2O
+
+
+ 1.700000E+15
+ 0
+ 29410.000000
+
+
+ H2O2:1 OH:1
+ H2O:1 HO2:1
+
+
+
+
+ OH + C [=] H + CO
+
+
+ 5.000000E+10
+ 0
+ 0.000000
+
+
+ C:1 OH:1
+ H:1 CO:1
+
+
+
+
+ OH + CH [=] H + HCO
+
+
+ 3.000000E+10
+ 0
+ 0.000000
+
+
+ CH:1 OH:1
+ H:1 HCO:1
+
+
+
+
+ OH + CH2 [=] H + CH2O
+
+
+ 2.000000E+10
+ 0
+ 0.000000
+
+
+ CH2:1 OH:1
+ CH2O:1 H:1
+
+
+
+
+ OH + CH2 [=] CH + H2O
+
+
+ 1.130000E+04
+ 2
+ 3000.000000
+
+
+ CH2:1 OH:1
+ H2O:1 CH:1
+
+
+
+
+ OH + CH2(S) [=] H + CH2O
+
+
+ 3.000000E+10
+ 0
+ 0.000000
+
+
+ CH2(S):1 OH:1
+ CH2O:1 H:1
+
+
+
+
+ OH + CH3 (+ M) [=] CH3OH (+ M)
+
+
+ 2.790000E+15
+ -1.4299999999999999
+ 1330.000000
+
+
+ 4.000000E+30
+ -5.9199999999999999
+ 3140.000000
+
+ C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.412 195 5900 6394
+
+ CH3:1 OH:1
+ CH3OH:1
+
+
+
+
+ OH + CH3 [=] CH2 + H2O
+
+
+ 5.600000E+04
+ 1.6000000000000001
+ 5420.000000
+
+
+ CH3:1 OH:1
+ CH2:1 H2O:1
+
+
+
+
+ OH + CH3 [=] CH2(S) + H2O
+
+
+ 6.440000E+14
+ -1.3400000000000001
+ 1417.000000
+
+
+ CH3:1 OH:1
+ CH2(S):1 H2O:1
+
+
+
+
+ OH + CH4 [=] CH3 + H2O
+
+
+ 1.000000E+05
+ 1.6000000000000001
+ 3120.000000
+
+
+ CH4:1 OH:1
+ H2O:1 CH3:1
+
+
+
+
+ OH + CO [=] H + CO2
+
+
+ 4.760000E+04
+ 1.228
+ 70.000000
+
+
+ CO:1 OH:1
+ H:1 CO2:1
+
+
+
+
+ OH + HCO [=] H2O + CO
+
+
+ 5.000000E+10
+ 0
+ 0.000000
+
+
+ HCO:1 OH:1
+ H2O:1 CO:1
+
+
+
+
+ OH + CH2O [=] HCO + H2O
+
+
+ 3.430000E+06
+ 1.1799999999999999
+ -447.000000
+
+
+ CH2O:1 OH:1
+ H2O:1 HCO:1
+
+
+
+
+ OH + CH2OH [=] H2O + CH2O
+
+
+ 5.000000E+09
+ 0
+ 0.000000
+
+
+ CH2OH:1 OH:1
+ CH2O:1 H2O:1
+
+
+
+
+ OH + CH3O [=] H2O + CH2O
+
+
+ 5.000000E+09
+ 0
+ 0.000000
+
+
+ CH3O:1 OH:1
+ CH2O:1 H2O:1
+
+
+
+
+ OH + CH3OH [=] CH2OH + H2O
+
+
+ 1.440000E+03
+ 2
+ -840.000000
+
+
+ CH3OH:1 OH:1
+ CH2OH:1 H2O:1
+
+
+
+
+ OH + CH3OH [=] CH3O + H2O
+
+
+ 6.300000E+03
+ 2
+ 1500.000000
+
+
+ CH3OH:1 OH:1
+ H2O:1 CH3O:1
+
+
+
+
+ OH + C2H [=] H + HCCO
+
+
+ 2.000000E+10
+ 0
+ 0.000000
+
+
+ C2H:1 OH:1
+ H:1 HCCO:1
+
+
+
+
+ OH + C2H2 [=] H + CH2CO
+
+
+ 2.180000E-07
+ 4.5
+ -1000.000000
+
+
+ C2H2:1 OH:1
+ H:1 CH2CO:1
+
+
+
+
+ OH + C2H2 [=] H + HCCOH
+
+
+ 5.040000E+02
+ 2.2999999999999998
+ 13500.000000
+
+
+ C2H2:1 OH:1
+ H:1 HCCOH:1
+
+
+
+
+ OH + C2H2 [=] C2H + H2O
+
+
+ 3.370000E+04
+ 2
+ 14000.000000
+
+
+ C2H2:1 OH:1
+ C2H:1 H2O:1
+
+
+
+
+ OH + C2H2 [=] CH3 + CO
+
+
+ 4.830000E-07
+ 4
+ -2000.000000
+
+
+ C2H2:1 OH:1
+ CH3:1 CO:1
+
+
+
+
+ OH + C2H3 [=] H2O + C2H2
+
+
+ 5.000000E+09
+ 0
+ 0.000000
+
+
+ C2H3:1 OH:1
+ H2O:1 C2H2:1
+
+
+
+
+ OH + C2H4 [=] C2H3 + H2O
+
+
+ 3.600000E+03
+ 2
+ 2500.000000
+
+
+ C2H4:1 OH:1
+ H2O:1 C2H3:1
+
+
+
+
+ OH + C2H6 [=] C2H5 + H2O
+
+
+ 3.540000E+03
+ 2.1200000000000001
+ 870.000000
+
+
+ C2H6:1 OH:1
+ C2H5:1 H2O:1
+
+
+
+
+ OH + CH2CO [=] HCCO + H2O
+
+
+ 7.500000E+09
+ 0
+ 2000.000000
+
+
+ CH2CO:1 OH:1
+ H2O:1 HCCO:1
+
+
+
+
+ 2 HO2 [=] O2 + H2O2
+
+
+ 1.300000E+08
+ 0
+ -1630.000000
+
+
+ HO2:2
+ O2:1 H2O2:1
+
+
+
+
+ 2 HO2 [=] O2 + H2O2
+
+
+ 4.200000E+11
+ 0
+ 12000.000000
+
+
+ HO2:2
+ O2:1 H2O2:1
+
+
+
+
+ HO2 + CH2 [=] OH + CH2O
+
+
+ 2.000000E+10
+ 0
+ 0.000000
+
+
+ CH2:1 HO2:1
+ CH2O:1 OH:1
+
+
+
+
+ HO2 + CH3 [=] O2 + CH4
+
+
+ 1.000000E+09
+ 0
+ 0.000000
+
+
+ CH3:1 HO2:1
+ CH4:1 O2:1
+
+
+
+
+ HO2 + CH3 [=] OH + CH3O
+
+
+ 3.780000E+10
+ 0
+ 0.000000
+
+
+ CH3:1 HO2:1
+ CH3O:1 OH:1
+
+
+
+
+ HO2 + CO [=] OH + CO2
+
+
+ 1.500000E+11
+ 0
+ 23600.000000
+
+
+ CO:1 HO2:1
+ CO2:1 OH:1
+
+
+
+
+ HO2 + CH2O [=] HCO + H2O2
+
+
+ 5.600000E+03
+ 2
+ 12000.000000
+
+
+ CH2O:1 HO2:1
+ HCO:1 H2O2:1
+
+
+
+
+ C + O2 [=] O + CO
+
+
+ 5.800000E+10
+ 0
+ 576.000000
+
+
+ C:1 O2:1
+ CO:1 O:1
+
+
+
+
+ C + CH2 [=] H + C2H
+
+
+ 5.000000E+10
+ 0
+ 0.000000
+
+
+ C:1 CH2:1
+ H:1 C2H:1
+
+
+
+
+ C + CH3 [=] H + C2H2
+
+
+ 5.000000E+10
+ 0
+ 0.000000
+
+
+ C:1 CH3:1
+ H:1 C2H2:1
+
+
+
+
+ CH + O2 [=] O + HCO
+
+
+ 6.710000E+10
+ 0
+ 0.000000
+
+
+ CH:1 O2:1
+ HCO:1 O:1
+
+
+
+
+ CH + H2 [=] H + CH2
+
+
+ 1.080000E+11
+ 0
+ 3110.000000
+
+
+ H2:1 CH:1
+ H:1 CH2:1
+
+
+
+
+ CH + H2O [=] H + CH2O
+
+
+ 5.710000E+09
+ 0
+ -755.000000
+
+
+ H2O:1 CH:1
+ CH2O:1 H:1
+
+
+
+
+ CH + CH2 [=] H + C2H2
+
+
+ 4.000000E+10
+ 0
+ 0.000000
+
+
+ CH2:1 CH:1
+ H:1 C2H2:1
+
+
+
+
+ CH + CH3 [=] H + C2H3
+
+
+ 3.000000E+10
+ 0
+ 0.000000
+
+
+ CH3:1 CH:1
+ H:1 C2H3:1
+
+
+
+
+ CH + CH4 [=] H + C2H4
+
+
+ 6.000000E+10
+ 0
+ 0.000000
+
+
+ CH:1 CH4:1
+ H:1 C2H4:1
+
+
+
+
+ CH + CO (+ M) [=] HCCO (+ M)
+
+
+ 5.000000E+10
+ 0
+ 0.000000
+
+
+ 2.690000E+22
+ -3.7400000000000002
+ 1936.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.5757 237 1652 5069
+
+ CH:1 CO:1
+ HCCO:1
+
+
+
+
+ CH + CO2 [=] HCO + CO
+
+
+ 1.900000E+11
+ 0
+ 15792.000000
+
+
+ CH:1 CO2:1
+ CO:1 HCO:1
+
+
+
+
+ CH + CH2O [=] H + CH2CO
+
+
+ 9.460000E+10
+ 0
+ -515.000000
+
+
+ CH2O:1 CH:1
+ H:1 CH2CO:1
+
+
+
+
+ CH + HCCO [=] CO + C2H2
+
+
+ 5.000000E+10
+ 0
+ 0.000000
+
+
+ CH:1 HCCO:1
+ CO:1 C2H2:1
+
+
+
+
+ CH2 + O2 =] OH + H + CO
+
+
+ 5.000000E+09
+ 0
+ 1500.000000
+
+
+ CH2:1 O2:1
+ H:1 CO:1 OH:1
+
+
+
+
+ CH2 + H2 [=] H + CH3
+
+
+ 5.000000E+02
+ 2
+ 7230.000000
+
+
+ H2:1 CH2:1
+ H:1 CH3:1
+
+
+
+
+ 2 CH2 [=] H2 + C2H2
+
+
+ 1.600000E+12
+ 0
+ 11944.000000
+
+
+ CH2:2
+ H2:1 C2H2:1
+
+
+
+
+ CH2 + CH3 [=] H + C2H4
+
+
+ 4.000000E+10
+ 0
+ 0.000000
+
+
+ CH2:1 CH3:1
+ H:1 C2H4:1
+
+
+
+
+ CH2 + CH4 [=] 2 CH3
+
+
+ 2.460000E+03
+ 2
+ 8270.000000
+
+
+ CH2:1 CH4:1
+ CH3:2
+
+
+
+
+ CH2 + CO (+ M) [=] CH2CO (+ M)
+
+
+ 8.100000E+08
+ 0.5
+ 4510.000000
+
+
+ 2.690000E+27
+ -5.1100000000000003
+ 7095.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.5907 275 1226 5185
+
+ CH2:1 CO:1
+ CH2CO:1
+
+
+
+
+ CH2 + HCCO [=] C2H3 + CO
+
+
+ 3.000000E+10
+ 0
+ 0.000000
+
+
+ CH2:1 HCCO:1
+ CO:1 C2H3:1
+
+
+
+
+ CH2(S) + N2 [=] CH2 + N2
+
+
+ 1.500000E+10
+ 0
+ 600.000000
+
+
+ CH2(S):1 N2:1
+ CH2:1 N2:1
+
+
+
+
+ CH2(S) + AR [=] CH2 + AR
+
+
+ 9.000000E+09
+ 0
+ 600.000000
+
+
+ CH2(S):1 AR:1
+ CH2:1 AR:1
+
+
+
+
+ CH2(S) + O2 [=] H + OH + CO
+
+
+ 2.800000E+10
+ 0
+ 0.000000
+
+
+ CH2(S):1 O2:1
+ H:1 CO:1 OH:1
+
+
+
+
+ CH2(S) + O2 [=] CO + H2O
+
+
+ 1.200000E+10
+ 0
+ 0.000000
+
+
+ CH2(S):1 O2:1
+ H2O:1 CO:1
+
+
+
+
+ CH2(S) + H2 [=] CH3 + H
+
+
+ 7.000000E+10
+ 0
+ 0.000000
+
+
+ H2:1 CH2(S):1
+ H:1 CH3:1
+
+
+
+
+ CH2(S) + H2O (+ M) [=] CH3OH (+ M)
+
+
+ 4.820000E+14
+ -1.1599999999999999
+ 1145.000000
+
+
+ 1.880000E+32
+ -6.3600000000000003
+ 5040.000000
+
+ C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.6027 208 3922 10180
+
+ CH2(S):1 H2O:1
+ CH3OH:1
+
+
+
+
+ CH2(S) + H2O [=] CH2 + H2O
+
+
+ 3.000000E+10
+ 0
+ 0.000000
+
+
+ CH2(S):1 H2O:1
+ CH2:1 H2O:1
+
+
+
+
+ CH2(S) + CH3 [=] H + C2H4
+
+
+ 1.200000E+10
+ 0
+ -570.000000
+
+
+ CH2(S):1 CH3:1
+ H:1 C2H4:1
+
+
+
+
+ CH2(S) + CH4 [=] 2 CH3
+
+
+ 1.600000E+10
+ 0
+ -570.000000
+
+
+ CH2(S):1 CH4:1
+ CH3:2
+
+
+
+
+ CH2(S) + CO [=] CH2 + CO
+
+
+ 9.000000E+09
+ 0
+ 0.000000
+
+
+ CH2(S):1 CO:1
+ CH2:1 CO:1
+
+
+
+
+ CH2(S) + CO2 [=] CH2 + CO2
+
+
+ 7.000000E+09
+ 0
+ 0.000000
+
+
+ CH2(S):1 CO2:1
+ CH2:1 CO2:1
+
+
+
+
+ CH2(S) + CO2 [=] CO + CH2O
+
+
+ 1.400000E+10
+ 0
+ 0.000000
+
+
+ CH2(S):1 CO2:1
+ CH2O:1 CO:1
+
+
+
+
+ CH2(S) + C2H6 [=] CH3 + C2H5
+
+
+ 4.000000E+10
+ 0
+ -550.000000
+
+
+ CH2(S):1 C2H6:1
+ C2H5:1 CH3:1
+
+
+
+
+ CH3 + O2 [=] O + CH3O
+
+
+ 3.560000E+10
+ 0
+ 30480.000000
+
+
+ CH3:1 O2:1
+ CH3O:1 O:1
+
+
+
+
+ CH3 + O2 [=] OH + CH2O
+
+
+ 2.310000E+09
+ 0
+ 20315.000000
+
+
+ CH3:1 O2:1
+ CH2O:1 OH:1
+
+
+
+
+ CH3 + H2O2 [=] HO2 + CH4
+
+
+ 2.450000E+01
+ 2.4700000000000002
+ 5180.000000
+
+
+ CH3:1 H2O2:1
+ CH4:1 HO2:1
+
+
+
+
+ 2 CH3 (+ M) [=] C2H6 (+ M)
+
+
+ 6.770000E+13
+ -1.1799999999999999
+ 654.000000
+
+
+ 3.400000E+35
+ -7.0300000000000002
+ 2762.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.619 73.2 1180 9999
+
+ CH3:2
+ C2H6:1
+
+
+
+
+ 2 CH3 [=] H + C2H5
+
+
+ 6.840000E+09
+ 0.10000000000000001
+ 10600.000000
+
+
+ CH3:2
+ H:1 C2H5:1
+
+
+
+
+ CH3 + HCO [=] CH4 + CO
+
+
+ 2.648000E+10
+ 0
+ 0.000000
+
+
+ CH3:1 HCO:1
+ CO:1 CH4:1
+
+
+
+
+ CH3 + CH2O [=] HCO + CH4
+
+
+ 3.320000E+00
+ 2.8100000000000001
+ 5860.000000
+
+
+ CH2O:1 CH3:1
+ CH4:1 HCO:1
+
+
+
+
+ CH3 + CH3OH [=] CH2OH + CH4
+
+
+ 3.000000E+04
+ 1.5
+ 9940.000000
+
+
+ CH3OH:1 CH3:1
+ CH2OH:1 CH4:1
+
+
+
+
+ CH3 + CH3OH [=] CH3O + CH4
+
+
+ 1.000000E+04
+ 1.5
+ 9940.000000
+
+
+ CH3OH:1 CH3:1
+ CH3O:1 CH4:1
+
+
+
+
+ CH3 + C2H4 [=] C2H3 + CH4
+
+
+ 2.270000E+02
+ 2
+ 9200.000000
+
+
+ CH3:1 C2H4:1
+ CH4:1 C2H3:1
+
+
+
+
+ CH3 + C2H6 [=] C2H5 + CH4
+
+
+ 6.140000E+03
+ 1.74
+ 10450.000000
+
+
+ C2H6:1 CH3:1
+ C2H5:1 CH4:1
+
+
+
+
+ HCO + H2O [=] H + CO + H2O
+
+
+ 1.500000E+15
+ -1
+ 17000.000000
+
+
+ H2O:1 HCO:1
+ H:1 H2O:1 CO:1
+
+
+
+
+ HCO + M [=] H + CO + M
+
+
+ 1.870000E+14
+ -1
+ 17000.000000
+
+ C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:0
+
+ HCO:1
+ H:1 CO:1
+
+
+
+
+ HCO + O2 [=] HO2 + CO
+
+
+ 1.345000E+10
+ 0
+ 400.000000
+
+
+ HCO:1 O2:1
+ CO:1 HO2:1
+
+
+
+
+ CH2OH + O2 [=] HO2 + CH2O
+
+
+ 1.800000E+10
+ 0
+ 900.000000
+
+
+ CH2OH:1 O2:1
+ CH2O:1 HO2:1
+
+
+
+
+ CH3O + O2 [=] HO2 + CH2O
+
+
+ 4.280000E-16
+ 7.5999999999999996
+ -3530.000000
+
+
+ CH3O:1 O2:1
+ CH2O:1 HO2:1
+
+
+
+
+ C2H + O2 [=] HCO + CO
+
+
+ 1.000000E+10
+ 0
+ -755.000000
+
+
+ C2H:1 O2:1
+ CO:1 HCO:1
+
+
+
+
+ C2H + H2 [=] H + C2H2
+
+
+ 5.680000E+07
+ 0.90000000000000002
+ 1993.000000
+
+
+ H2:1 C2H:1
+ H:1 C2H2:1
+
+
+
+
+ C2H3 + O2 [=] HCO + CH2O
+
+
+ 4.580000E+13
+ -1.3899999999999999
+ 1015.000000
+
+
+ C2H3:1 O2:1
+ CH2O:1 HCO:1
+
+
+
+
+ C2H4 (+ M) [=] H2 + C2H2 (+ M)
+
+
+ 8.000000E+12
+ 0.44
+ 86770.000000
+
+
+ 1.580000E+48
+ -9.3000000000000007
+ 97800.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.7345 180 1035 5417
+
+ C2H4:1
+ H2:1 C2H2:1
+
+
+
+
+ C2H5 + O2 [=] HO2 + C2H4
+
+
+ 8.400000E+08
+ 0
+ 3875.000000
+
+
+ C2H5:1 O2:1
+ C2H4:1 HO2:1
+
+
+
+
+ HCCO + O2 [=] OH + 2 CO
+
+
+ 3.200000E+09
+ 0
+ 854.000000
+
+
+ HCCO:1 O2:1
+ CO:2 OH:1
+
+
+
+
+ 2 HCCO [=] 2 CO + C2H2
+
+
+ 1.000000E+10
+ 0
+ 0.000000
+
+
+ HCCO:2
+ CO:2 C2H2:1
+
+
+
+
+ N + NO [=] N2 + O
+
+
+ 2.700000E+10
+ 0
+ 355.000000
+
+
+ NO:1 N:1
+ N2:1 O:1
+
+
+
+
+ N + O2 [=] NO + O
+
+
+ 9.000000E+06
+ 1
+ 6500.000000
+
+
+ O2:1 N:1
+ O:1 NO:1
+
+
+
+
+ N + OH [=] NO + H
+
+
+ 3.360000E+10
+ 0
+ 385.000000
+
+
+ OH:1 N:1
+ H:1 NO:1
+
+
+
+
+ N2O + O [=] N2 + O2
+
+
+ 1.400000E+09
+ 0
+ 10810.000000
+
+
+ N2O:1 O:1
+ N2:1 O2:1
+
+
+
+
+ N2O + O [=] 2 NO
+
+
+ 2.900000E+10
+ 0
+ 23150.000000
+
+
+ N2O:1 O:1
+ NO:2
+
+
+
+
+ N2O + H [=] N2 + OH
+
+
+ 3.870000E+11
+ 0
+ 18880.000000
+
+
+ H:1 N2O:1
+ N2:1 OH:1
+
+
+
+
+ N2O + OH [=] N2 + HO2
+
+
+ 2.000000E+09
+ 0
+ 21060.000000
+
+
+ N2O:1 OH:1
+ N2:1 HO2:1
+
+
+
+
+ N2O (+ M) [=] N2 + O (+ M)
+
+
+ 7.910000E+10
+ 0
+ 56020.000000
+
+
+ 6.370000E+11
+ 0
+ 56640.000000
+
+ AR:0.625 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+
+
+ N2O:1
+ N2:1 O:1
+
+
+
+
+ HO2 + NO [=] NO2 + OH
+
+
+ 2.110000E+09
+ 0
+ -480.000000
+
+
+ HO2:1 NO:1
+ NO2:1 OH:1
+
+
+
+
+ NO + O + M [=] NO2 + M
+
+
+ 1.060000E+14
+ -1.4099999999999999
+ 0.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+
+ O:1 NO:1
+ NO2:1
+
+
+
+
+ NO2 + O [=] NO + O2
+
+
+ 3.900000E+09
+ 0
+ -240.000000
+
+
+ O:1 NO2:1
+ O2:1 NO:1
+
+
+
+
+ NO2 + H [=] NO + OH
+
+
+ 1.320000E+11
+ 0
+ 360.000000
+
+
+ H:1 NO2:1
+ OH:1 NO:1
+
+
+
+
+ NH + O [=] NO + H
+
+
+ 4.000000E+10
+ 0
+ 0.000000
+
+
+ NH:1 O:1
+ H:1 NO:1
+
+
+
+
+ NH + H [=] N + H2
+
+
+ 3.200000E+10
+ 0
+ 330.000000
+
+
+ NH:1 H:1
+ H2:1 N:1
+
+
+
+
+ NH + OH [=] HNO + H
+
+
+ 2.000000E+10
+ 0
+ 0.000000
+
+
+ NH:1 OH:1
+ H:1 HNO:1
+
+
+
+
+ NH + OH [=] N + H2O
+
+
+ 2.000000E+06
+ 1.2
+ 0.000000
+
+
+ NH:1 OH:1
+ H2O:1 N:1
+
+
+
+
+ NH + O2 [=] HNO + O
+
+
+ 4.610000E+02
+ 2
+ 6500.000000
+
+
+ NH:1 O2:1
+ O:1 HNO:1
+
+
+
+
+ NH + O2 [=] NO + OH
+
+
+ 1.280000E+03
+ 1.5
+ 100.000000
+
+
+ NH:1 O2:1
+ OH:1 NO:1
+
+
+
+
+ NH + N [=] N2 + H
+
+
+ 1.500000E+10
+ 0
+ 0.000000
+
+
+ NH:1 N:1
+ H:1 N2:1
+
+
+
+
+ NH + H2O [=] HNO + H2
+
+
+ 2.000000E+10
+ 0
+ 13850.000000
+
+
+ NH:1 H2O:1
+ H2:1 HNO:1
+
+
+
+
+ NH + NO [=] N2 + OH
+
+
+ 2.160000E+10
+ -0.23000000000000001
+ 0.000000
+
+
+ NH:1 NO:1
+ N2:1 OH:1
+
+
+
+
+ NH + NO [=] N2O + H
+
+
+ 3.650000E+11
+ -0.45000000000000001
+ 0.000000
+
+
+ NH:1 NO:1
+ H:1 N2O:1
+
+
+
+
+ NH2 + O [=] OH + NH
+
+
+ 3.000000E+09
+ 0
+ 0.000000
+
+
+ O:1 NH2:1
+ NH:1 OH:1
+
+
+
+
+ NH2 + O [=] H + HNO
+
+
+ 3.900000E+10
+ 0
+ 0.000000
+
+
+ O:1 NH2:1
+ H:1 HNO:1
+
+
+
+
+ NH2 + H [=] NH + H2
+
+
+ 4.000000E+10
+ 0
+ 3650.000000
+
+
+ H:1 NH2:1
+ NH:1 H2:1
+
+
+
+
+ NH2 + OH [=] NH + H2O
+
+
+ 9.000000E+04
+ 1.5
+ -460.000000
+
+
+ OH:1 NH2:1
+ NH:1 H2O:1
+
+
+
+
+ NNH [=] N2 + H
+
+
+ 3.300000E+08
+ 0
+ 0.000000
+
+
+ NNH:1
+ H:1 N2:1
+
+
+
+
+ NNH + M [=] N2 + H + M
+
+
+ 1.300000E+11
+ -0.11
+ 4980.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+
+ NNH:1
+ H:1 N2:1
+
+
+
+
+ NNH + O2 [=] HO2 + N2
+
+
+ 5.000000E+09
+ 0
+ 0.000000
+
+
+ O2:1 NNH:1
+ N2:1 HO2:1
+
+
+
+
+ NNH + O [=] OH + N2
+
+
+ 2.500000E+10
+ 0
+ 0.000000
+
+
+ O:1 NNH:1
+ N2:1 OH:1
+
+
+
+
+ NNH + O [=] NH + NO
+
+
+ 7.000000E+10
+ 0
+ 0.000000
+
+
+ O:1 NNH:1
+ NH:1 NO:1
+
+
+
+
+ NNH + H [=] H2 + N2
+
+
+ 5.000000E+10
+ 0
+ 0.000000
+
+
+ H:1 NNH:1
+ H2:1 N2:1
+
+
+
+
+ NNH + OH [=] H2O + N2
+
+
+ 2.000000E+10
+ 0
+ 0.000000
+
+
+ OH:1 NNH:1
+ H2O:1 N2:1
+
+
+
+
+ NNH + CH3 [=] CH4 + N2
+
+
+ 2.500000E+10
+ 0
+ 0.000000
+
+
+ CH3:1 NNH:1
+ N2:1 CH4:1
+
+
+
+
+ H + NO + M [=] HNO + M
+
+
+ 4.480000E+13
+ -1.3200000000000001
+ 740.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+
+ H:1 NO:1
+ HNO:1
+
+
+
+
+ HNO + O [=] NO + OH
+
+
+ 2.500000E+10
+ 0
+ 0.000000
+
+
+ O:1 HNO:1
+ OH:1 NO:1
+
+
+
+
+ HNO + H [=] H2 + NO
+
+
+ 9.000000E+08
+ 0.71999999999999997
+ 660.000000
+
+
+ H:1 HNO:1
+ H2:1 NO:1
+
+
+
+
+ HNO + OH [=] NO + H2O
+
+
+ 1.300000E+04
+ 1.8999999999999999
+ -950.000000
+
+
+ HNO:1 OH:1
+ H2O:1 NO:1
+
+
+
+
+ HNO + O2 [=] HO2 + NO
+
+
+ 1.000000E+10
+ 0
+ 13000.000000
+
+
+ O2:1 HNO:1
+ HO2:1 NO:1
+
+
+
+
+ CN + O [=] CO + N
+
+
+ 7.700000E+10
+ 0
+ 0.000000
+
+
+ CN:1 O:1
+ CO:1 N:1
+
+
+
+
+ CN + OH [=] NCO + H
+
+
+ 4.000000E+10
+ 0
+ 0.000000
+
+
+ CN:1 OH:1
+ H:1 NCO:1
+
+
+
+
+ CN + H2O [=] HCN + OH
+
+
+ 8.000000E+09
+ 0
+ 7460.000000
+
+
+ H2O:1 CN:1
+ HCN:1 OH:1
+
+
+
+
+ CN + O2 [=] NCO + O
+
+
+ 6.140000E+09
+ 0
+ -440.000000
+
+
+ CN:1 O2:1
+ O:1 NCO:1
+
+
+
+
+ CN + H2 [=] HCN + H
+
+
+ 2.950000E+02
+ 2.4500000000000002
+ 2240.000000
+
+
+ H2:1 CN:1
+ H:1 HCN:1
+
+
+
+
+ NCO + O [=] NO + CO
+
+
+ 2.350000E+10
+ 0
+ 0.000000
+
+
+ O:1 NCO:1
+ CO:1 NO:1
+
+
+
+
+ NCO + H [=] NH + CO
+
+
+ 5.400000E+10
+ 0
+ 0.000000
+
+
+ H:1 NCO:1
+ NH:1 CO:1
+
+
+
+
+ NCO + OH [=] NO + H + CO
+
+
+ 2.500000E+09
+ 0
+ 0.000000
+
+
+ OH:1 NCO:1
+ H:1 CO:1 NO:1
+
+
+
+
+ NCO + N [=] N2 + CO
+
+
+ 2.000000E+10
+ 0
+ 0.000000
+
+
+ N:1 NCO:1
+ N2:1 CO:1
+
+
+
+
+ NCO + O2 [=] NO + CO2
+
+
+ 2.000000E+09
+ 0
+ 20000.000000
+
+
+ O2:1 NCO:1
+ CO2:1 NO:1
+
+
+
+
+ NCO + M [=] N + CO + M
+
+
+ 3.100000E+11
+ 0
+ 54050.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+
+ NCO:1
+ CO:1 N:1
+
+
+
+
+ NCO + NO [=] N2O + CO
+
+
+ 1.900000E+14
+ -1.52
+ 740.000000
+
+
+ NO:1 NCO:1
+ CO:1 N2O:1
+
+
+
+
+ NCO + NO [=] N2 + CO2
+
+
+ 3.800000E+15
+ -2
+ 800.000000
+
+
+ NO:1 NCO:1
+ N2:1 CO2:1
+
+
+
+
+ HCN + M [=] H + CN + M
+
+
+ 1.040000E+26
+ -3.2999999999999998
+ 126600.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+
+ HCN:1
+ H:1 CN:1
+
+
+
+
+ HCN + O [=] NCO + H
+
+
+ 2.030000E+01
+ 2.6400000000000001
+ 4980.000000
+
+
+ HCN:1 O:1
+ H:1 NCO:1
+
+
+
+
+ HCN + O [=] NH + CO
+
+
+ 5.070000E+00
+ 2.6400000000000001
+ 4980.000000
+
+
+ HCN:1 O:1
+ NH:1 CO:1
+
+
+
+
+ HCN + O [=] CN + OH
+
+
+ 3.910000E+06
+ 1.5800000000000001
+ 26600.000000
+
+
+ HCN:1 O:1
+ CN:1 OH:1
+
+
+
+
+ HCN + OH [=] HOCN + H
+
+
+ 1.100000E+03
+ 2.0299999999999998
+ 13370.000000
+
+
+ HCN:1 OH:1
+ HOCN:1 H:1
+
+
+
+
+ HCN + OH [=] HNCO + H
+
+
+ 4.400000E+00
+ 2.2599999999999998
+ 6400.000000
+
+
+ HCN:1 OH:1
+ HNCO:1 H:1
+
+
+
+
+ HCN + OH [=] NH2 + CO
+
+
+ 1.600000E-01
+ 2.5600000000000001
+ 9000.000000
+
+
+ HCN:1 OH:1
+ CO:1 NH2:1
+
+
+
+
+ H + HCN (+ M) [=] H2CN (+ M)
+
+
+ 3.300000E+10
+ 0
+ 0.000000
+
+
+ 1.400000E+20
+ -3.3999999999999999
+ 1900.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+
+
+ H:1 HCN:1
+ H2CN:1
+
+
+
+
+ H2CN + N [=] N2 + CH2
+
+
+ 6.000000E+10
+ 0
+ 400.000000
+
+
+ H2CN:1 N:1
+ N2:1 CH2:1
+
+
+
+
+ C + N2 [=] CN + N
+
+
+ 6.300000E+10
+ 0
+ 46020.000000
+
+
+ C:1 N2:1
+ CN:1 N:1
+
+
+
+
+ CH + N2 [=] HCN + N
+
+
+ 3.120000E+06
+ 0.88
+ 20130.000000
+
+
+ N2:1 CH:1
+ HCN:1 N:1
+
+
+
+
+ CH + N2 (+ M) [=] HCNN (+ M)
+
+
+ 3.100000E+09
+ 0.14999999999999999
+ 0.000000
+
+
+ 1.300000E+19
+ -3.1600000000000001
+ 740.000000
+
+ AR:1 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.667 235 2117 4536
+
+ N2:1 CH:1
+ HCNN:1
+
+
+
+
+ CH2 + N2 [=] HCN + NH
+
+
+ 1.000000E+10
+ 0
+ 74000.000000
+
+
+ CH2:1 N2:1
+ NH:1 HCN:1
+
+
+
+
+ CH2(S) + N2 [=] NH + HCN
+
+
+ 1.000000E+08
+ 0
+ 65000.000000
+
+
+ CH2(S):1 N2:1
+ NH:1 HCN:1
+
+
+
+
+ C + NO [=] CN + O
+
+
+ 1.900000E+10
+ 0
+ 0.000000
+
+
+ C:1 NO:1
+ CN:1 O:1
+
+
+
+
+ C + NO [=] CO + N
+
+
+ 2.900000E+10
+ 0
+ 0.000000
+
+
+ C:1 NO:1
+ CO:1 N:1
+
+
+
+
+ CH + NO [=] HCN + O
+
+
+ 4.100000E+10
+ 0
+ 0.000000
+
+
+ CH:1 NO:1
+ HCN:1 O:1
+
+
+
+
+ CH + NO [=] H + NCO
+
+
+ 1.620000E+10
+ 0
+ 0.000000
+
+
+ CH:1 NO:1
+ H:1 NCO:1
+
+
+
+
+ CH + NO [=] N + HCO
+
+
+ 2.460000E+10
+ 0
+ 0.000000
+
+
+ CH:1 NO:1
+ HCO:1 N:1
+
+
+
+
+ CH2 + NO [=] H + HNCO
+
+
+ 3.100000E+14
+ -1.3799999999999999
+ 1270.000000
+
+
+ CH2:1 NO:1
+ HNCO:1 H:1
+
+
+
+
+ CH2 + NO [=] OH + HCN
+
+
+ 2.900000E+11
+ -0.68999999999999995
+ 760.000000
+
+
+ CH2:1 NO:1
+ HCN:1 OH:1
+
+
+
+
+ CH2 + NO [=] H + HCNO
+
+
+ 3.800000E+10
+ -0.35999999999999999
+ 580.000000
+
+
+ CH2:1 NO:1
+ H:1 HCNO:1
+
+
+
+
+ CH2(S) + NO [=] H + HNCO
+
+
+ 3.100000E+14
+ -1.3799999999999999
+ 1270.000000
+
+
+ CH2(S):1 NO:1
+ HNCO:1 H:1
+
+
+
+
+ CH2(S) + NO [=] OH + HCN
+
+
+ 2.900000E+11
+ -0.68999999999999995
+ 760.000000
+
+
+ CH2(S):1 NO:1
+ HCN:1 OH:1
+
+
+
+
+ CH2(S) + NO [=] H + HCNO
+
+
+ 3.800000E+10
+ -0.35999999999999999
+ 580.000000
+
+
+ CH2(S):1 NO:1
+ H:1 HCNO:1
+
+
+
+
+ CH3 + NO [=] HCN + H2O
+
+
+ 9.600000E+10
+ 0
+ 28800.000000
+
+
+ CH3:1 NO:1
+ H2O:1 HCN:1
+
+
+
+
+ CH3 + NO [=] H2CN + OH
+
+
+ 1.000000E+09
+ 0
+ 21750.000000
+
+
+ CH3:1 NO:1
+ H2CN:1 OH:1
+
+
+
+
+ HCNN + O [=] CO + H + N2
+
+
+ 2.200000E+10
+ 0
+ 0.000000
+
+
+ O:1 HCNN:1
+ H:1 N2:1 CO:1
+
+
+
+
+ HCNN + O [=] HCN + NO
+
+
+ 2.000000E+09
+ 0
+ 0.000000
+
+
+ O:1 HCNN:1
+ HCN:1 NO:1
+
+
+
+
+ HCNN + O2 [=] O + HCO + N2
+
+
+ 1.200000E+10
+ 0
+ 0.000000
+
+
+ O2:1 HCNN:1
+ N2:1 HCO:1 O:1
+
+
+
+
+ HCNN + OH [=] H + HCO + N2
+
+
+ 1.200000E+10
+ 0
+ 0.000000
+
+
+ OH:1 HCNN:1
+ H:1 N2:1 HCO:1
+
+
+
+
+ HCNN + H [=] CH2 + N2
+
+
+ 1.000000E+11
+ 0
+ 0.000000
+
+
+ H:1 HCNN:1
+ CH2:1 N2:1
+
+
+
+
+ HNCO + O [=] NH + CO2
+
+
+ 9.800000E+04
+ 1.4099999999999999
+ 8500.000000
+
+
+ HNCO:1 O:1
+ NH:1 CO2:1
+
+
+
+
+ HNCO + O [=] HNO + CO
+
+
+ 1.500000E+05
+ 1.5700000000000001
+ 44000.000000
+
+
+ HNCO:1 O:1
+ CO:1 HNO:1
+
+
+
+
+ HNCO + O [=] NCO + OH
+
+
+ 2.200000E+03
+ 2.1099999999999999
+ 11400.000000
+
+
+ HNCO:1 O:1
+ OH:1 NCO:1
+
+
+
+
+ HNCO + H [=] NH2 + CO
+
+
+ 2.250000E+04
+ 1.7
+ 3800.000000
+
+
+ HNCO:1 H:1
+ CO:1 NH2:1
+
+
+
+
+ HNCO + H [=] H2 + NCO
+
+
+ 1.050000E+02
+ 2.5
+ 13300.000000
+
+
+ HNCO:1 H:1
+ H2:1 NCO:1
+
+
+
+
+ HNCO + OH [=] NCO + H2O
+
+
+ 3.300000E+04
+ 1.5
+ 3600.000000
+
+
+ HNCO:1 OH:1
+ H2O:1 NCO:1
+
+
+
+
+ HNCO + OH [=] NH2 + CO2
+
+
+ 3.300000E+03
+ 1.5
+ 3600.000000
+
+
+ HNCO:1 OH:1
+ CO2:1 NH2:1
+
+
+
+
+ HNCO + M [=] NH + CO + M
+
+
+ 1.180000E+13
+ 0
+ 84720.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+
+ HNCO:1
+ NH:1 CO:1
+
+
+
+
+ HCNO + H [=] H + HNCO
+
+
+ 2.100000E+12
+ -0.68999999999999995
+ 2850.000000
+
+
+ H:1 HCNO:1
+ HNCO:1 H:1
+
+
+
+
+ HCNO + H [=] OH + HCN
+
+
+ 2.700000E+08
+ 0.17999999999999999
+ 2120.000000
+
+
+ H:1 HCNO:1
+ HCN:1 OH:1
+
+
+
+
+ HCNO + H [=] NH2 + CO
+
+
+ 1.700000E+11
+ -0.75
+ 2890.000000
+
+
+ H:1 HCNO:1
+ CO:1 NH2:1
+
+
+
+
+ HOCN + H [=] H + HNCO
+
+
+ 2.000000E+04
+ 2
+ 2000.000000
+
+
+ HOCN:1 H:1
+ HNCO:1 H:1
+
+
+
+
+ HCCO + NO [=] HCNO + CO
+
+
+ 9.000000E+09
+ 0
+ 0.000000
+
+
+ HCCO:1 NO:1
+ CO:1 HCNO:1
+
+
+
+
+ CH3 + N [=] H2CN + H
+
+
+ 6.100000E+11
+ -0.31
+ 290.000000
+
+
+ CH3:1 N:1
+ H:1 H2CN:1
+
+
+
+
+ CH3 + N [=] HCN + H2
+
+
+ 3.700000E+09
+ 0.14999999999999999
+ -90.000000
+
+
+ CH3:1 N:1
+ H2:1 HCN:1
+
+
+
+
+ NH3 + H [=] NH2 + H2
+
+
+ 5.400000E+02
+ 2.3999999999999999
+ 9915.000000
+
+
+ H:1 NH3:1
+ H2:1 NH2:1
+
+
+
+
+ NH3 + OH [=] NH2 + H2O
+
+
+ 5.000000E+04
+ 1.6000000000000001
+ 955.000000
+
+
+ NH3:1 OH:1
+ H2O:1 NH2:1
+
+
+
+
+ NH3 + O [=] NH2 + OH
+
+
+ 9.400000E+03
+ 1.9399999999999999
+ 6460.000000
+
+
+ O:1 NH3:1
+ OH:1 NH2:1
+
+
+
+
+ NH + CO2 [=] HNO + CO
+
+
+ 1.000000E+10
+ 0
+ 14350.000000
+
+
+ NH:1 CO2:1
+ CO:1 HNO:1
+
+
+
+
+ CN + NO2 [=] NCO + NO
+
+
+ 6.160000E+12
+ -0.752
+ 345.000000
+
+
+ CN:1 NO2:1
+ NO:1 NCO:1
+
+
+
+
+ NCO + NO2 [=] N2O + CO2
+
+
+ 3.250000E+09
+ 0
+ -705.000000
+
+
+ NO2:1 NCO:1
+ CO2:1 N2O:1
+
+
+
+
+ N + CO2 [=] NO + CO
+
+
+ 3.000000E+09
+ 0
+ 11300.000000
+
+
+ CO2:1 N:1
+ CO:1 NO:1
+
+
+
+
+ O + CH3 =] H + H2 + CO
+
+
+ 3.370000E+10
+ 0
+ 0.000000
+
+
+ CH3:1 O:1
+ H2:1 H:1 CO:1
+
+
+
+
+ O + C2H4 [=] H + CH2CHO
+
+
+ 6.700000E+03
+ 1.8300000000000001
+ 220.000000
+
+
+ C2H4:1 O:1
+ H:1 CH2CHO:1
+
+
+
+
+ O + C2H5 [=] H + CH3CHO
+
+
+ 1.096000E+11
+ 0
+ 0.000000
+
+
+ C2H5:1 O:1
+ H:1 CH3CHO:1
+
+
+
+
+ OH + HO2 [=] O2 + H2O
+
+
+ 5.000000E+12
+ 0
+ 17330.000000
+
+
+ HO2:1 OH:1
+ H2O:1 O2:1
+
+
+
+
+ OH + CH3 =] H2 + CH2O
+
+
+ 8.000000E+06
+ 0.5
+ -1755.000000
+
+
+ CH3:1 OH:1
+ H2:1 CH2O:1
+
+
+
+
+ CH + H2 (+ M) [=] CH3 (+ M)
+
+
+ 1.970000E+09
+ 0.42999999999999999
+ -370.000000
+
+
+ 4.820000E+19
+ -2.7999999999999998
+ 590.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.578 122 2535 9365
+
+ H2:1 CH:1
+ CH3:1
+
+
+
+
+ CH2 + O2 =] 2 H + CO2
+
+
+ 5.800000E+09
+ 0
+ 1500.000000
+
+
+ CH2:1 O2:1
+ H:2 CO2:1
+
+
+
+
+ CH2 + O2 [=] O + CH2O
+
+
+ 2.400000E+09
+ 0
+ 1500.000000
+
+
+ CH2:1 O2:1
+ CH2O:1 O:1
+
+
+
+
+ CH2 + CH2 =] 2 H + C2H2
+
+
+ 2.000000E+11
+ 0
+ 10989.000000
+
+
+ CH2:2
+ H:2 C2H2:1
+
+
+
+
+ CH2(S) + H2O =] H2 + CH2O
+
+
+ 6.820000E+07
+ 0.25
+ -935.000000
+
+
+ CH2(S):1 H2O:1
+ H2:1 CH2O:1
+
+
+
+
+ C2H3 + O2 [=] O + CH2CHO
+
+
+ 3.030000E+08
+ 0.28999999999999998
+ 11.000000
+
+
+ C2H3:1 O2:1
+ CH2CHO:1 O:1
+
+
+
+
+ C2H3 + O2 [=] HO2 + C2H2
+
+
+ 1.337000E+03
+ 1.6100000000000001
+ -384.000000
+
+
+ C2H3:1 O2:1
+ HO2:1 C2H2:1
+
+
+
+
+ O + CH3CHO [=] OH + CH2CHO
+
+
+ 5.840000E+09
+ 0
+ 1808.000000
+
+
+ CH3CHO:1 O:1
+ CH2CHO:1 OH:1
+
+
+
+
+ O + CH3CHO =] OH + CH3 + CO
+
+
+ 5.840000E+09
+ 0
+ 1808.000000
+
+
+ CH3CHO:1 O:1
+ CH3:1 CO:1 OH:1
+
+
+
+
+ O2 + CH3CHO =] HO2 + CH3 + CO
+
+
+ 3.010000E+10
+ 0
+ 39150.000000
+
+
+ CH3CHO:1 O2:1
+ CO:1 CH3:1 HO2:1
+
+
+
+
+ H + CH3CHO [=] CH2CHO + H2
+
+
+ 2.050000E+06
+ 1.1599999999999999
+ 2405.000000
+
+
+ H:1 CH3CHO:1
+ H2:1 CH2CHO:1
+
+
+
+
+ H + CH3CHO =] CH3 + H2 + CO
+
+
+ 2.050000E+06
+ 1.1599999999999999
+ 2405.000000
+
+
+ H:1 CH3CHO:1
+ H2:1 CH3:1 CO:1
+
+
+
+
+ OH + CH3CHO =] CH3 + H2O + CO
+
+
+ 2.343000E+07
+ 0.72999999999999998
+ -1113.000000
+
+
+ CH3CHO:1 OH:1
+ H2O:1 CH3:1 CO:1
+
+
+
+
+ HO2 + CH3CHO =] CH3 + H2O2 + CO
+
+
+ 3.010000E+09
+ 0
+ 11923.000000
+
+
+ CH3CHO:1 HO2:1
+ CH3:1 CO:1 H2O2:1
+
+
+
+
+ CH3 + CH3CHO =] CH3 + CH4 + CO
+
+
+ 2.720000E+03
+ 1.77
+ 5920.000000
+
+
+ CH3CHO:1 CH3:1
+ CO:1 CH3:1 CH4:1
+
+
+
+
+ H + CH2CO (+ M) [=] CH2CHO (+ M)
+
+
+ 4.865000E+08
+ 0.42199999999999999
+ -1755.000000
+
+
+ 1.012000E+36
+ -7.6299999999999999
+ 3854.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.465 201 1773 5333
+
+ H:1 CH2CO:1
+ CH2CHO:1
+
+
+
+
+ O + CH2CHO =] H + CH2 + CO2
+
+
+ 1.500000E+11
+ 0
+ 0.000000
+
+
+ CH2CHO:1 O:1
+ H:1 CH2:1 CO2:1
+
+
+
+
+ O2 + CH2CHO =] OH + CO + CH2O
+
+
+ 1.810000E+07
+ 0
+ 0.000000
+
+
+ CH2CHO:1 O2:1
+ CH2O:1 CO:1 OH:1
+
+
+
+
+ O2 + CH2CHO =] OH + 2 HCO
+
+
+ 2.350000E+07
+ 0
+ 0.000000
+
+
+ CH2CHO:1 O2:1
+ HCO:2 OH:1
+
+
+
+
+ H + CH2CHO [=] CH3 + HCO
+
+
+ 2.200000E+10
+ 0
+ 0.000000
+
+
+ H:1 CH2CHO:1
+ CH3:1 HCO:1
+
+
+
+
+ H + CH2CHO [=] CH2CO + H2
+
+
+ 1.100000E+10
+ 0
+ 0.000000
+
+
+ H:1 CH2CHO:1
+ H2:1 CH2CO:1
+
+
+
+
+ OH + CH2CHO [=] H2O + CH2CO
+
+
+ 1.200000E+10
+ 0
+ 0.000000
+
+
+ CH2CHO:1 OH:1
+ H2O:1 CH2CO:1
+
+
+
+
+ OH + CH2CHO [=] HCO + CH2OH
+
+
+ 3.010000E+10
+ 0
+ 0.000000
+
+
+ CH2CHO:1 OH:1
+ CH2OH:1 HCO:1
+
+
+
+
+ CH3 + C2H5 (+ M) [=] C3H8 (+ M)
+
+
+ 9.430000E+09
+ 0
+ 0.000000
+
+
+ 2.710000E+68
+ -16.82
+ 13065.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.1527 291 2742 7748
+
+ C2H5:1 CH3:1
+ C3H8:1
+
+
+
+
+ O + C3H8 [=] OH + C3H7
+
+
+ 1.930000E+02
+ 2.6800000000000002
+ 3716.000000
+
+
+ C3H8:1 O:1
+ C3H7:1 OH:1
+
+
+
+
+ H + C3H8 [=] C3H7 + H2
+
+
+ 1.320000E+03
+ 2.54
+ 6756.000000
+
+
+ H:1 C3H8:1
+ H2:1 C3H7:1
+
+
+
+
+ OH + C3H8 [=] C3H7 + H2O
+
+
+ 3.160000E+04
+ 1.8
+ 934.000000
+
+
+ C3H8:1 OH:1
+ C3H7:1 H2O:1
+
+
+
+
+ C3H7 + H2O2 [=] HO2 + C3H8
+
+
+ 3.780000E-01
+ 2.7200000000000002
+ 1500.000000
+
+
+ C3H7:1 H2O2:1
+ HO2:1 C3H8:1
+
+
+
+
+ CH3 + C3H8 [=] C3H7 + CH4
+
+
+ 9.030000E-04
+ 3.6499999999999999
+ 7154.000000
+
+
+ CH3:1 C3H8:1
+ C3H7:1 CH4:1
+
+
+
+
+ CH3 + C2H4 (+ M) [=] C3H7 (+ M)
+
+
+ 2.550000E+03
+ 1.6000000000000001
+ 5700.000000
+
+
+ 3.000000E+57
+ -14.6
+ 18170.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.1894 277 8748 7891
+
+ CH3:1 C2H4:1
+ C3H7:1
+
+
+
+
+ O + C3H7 [=] C2H5 + CH2O
+
+
+ 9.640000E+10
+ 0
+ 0.000000
+
+
+ C3H7:1 O:1
+ CH2O:1 C2H5:1
+
+
+
+
+ H + C3H7 (+ M) [=] C3H8 (+ M)
+
+
+ 3.613000E+10
+ 0
+ 0.000000
+
+
+ 4.420000E+55
+ -13.545
+ 11357.000000
+
+ AR:0.7 C2H6:3 CH4:2 CO:1.5 CO2:2 H2:2 H2O:6
+ 0.315 369 3285 6667
+
+ H:1 C3H7:1
+ C3H8:1
+
+
+
+
+ H + C3H7 [=] CH3 + C2H5
+
+
+ 4.060000E+03
+ 2.1899999999999999
+ 890.000000
+
+
+ H:1 C3H7:1
+ C2H5:1 CH3:1
+
+
+
+
+ OH + C3H7 [=] C2H5 + CH2OH
+
+
+ 2.410000E+10
+ 0
+ 0.000000
+
+
+ C3H7:1 OH:1
+ CH2OH:1 C2H5:1
+
+
+
+
+ HO2 + C3H7 [=] O2 + C3H8
+
+
+ 2.550000E+07
+ 0.255
+ -943.000000
+
+
+ C3H7:1 HO2:1
+ O2:1 C3H8:1
+
+
+
+
+ HO2 + C3H7 =] OH + C2H5 + CH2O
+
+
+ 2.410000E+10
+ 0
+ 0.000000
+
+
+ C3H7:1 HO2:1
+ CH2O:1 C2H5:1 OH:1
+
+
+
+
+ CH3 + C3H7 [=] 2 C2H5
+
+
+ 1.927000E+10
+ -0.32000000000000001
+ 0.000000
+
+
+ C3H7:1 CH3:1
+ C2H5:2
+
+
+
diff --git a/test_problems/multiGasTransport/multiGasTransport.cpp b/test_problems/multiGasTransport/multiGasTransport.cpp
new file mode 100644
index 000000000..cc2d5de62
--- /dev/null
+++ b/test_problems/multiGasTransport/multiGasTransport.cpp
@@ -0,0 +1,275 @@
+/**
+ * @file multiGasTransport.cpp
+ * test problem for multi transport
+ */
+
+// Example
+//
+// Test case for mixture transport in a gas
+// The basic idea is to set up a gradient of some kind.
+// Then the resulting transport coefficients out.
+// Essentially all of the interface routines should be
+// exercised and the results dumped out.
+//
+// A blessed solution test will make sure that the actual
+// solution doesn't change as a function of time or
+// further development.
+
+// perhaps, later, an analytical solution could be added
+
+
+#include
+#include
+#include
+#include
+#include
+
+using namespace std;
+
+
+#define MAX(x,y) (( (x) > (y) ) ? (x) : (y))
+
+/*****************************************************************/
+/*****************************************************************/
+
+#include "Cantera.h"
+#include "transport.h"
+#include "IdealGasMix.h"
+
+#include "kernel/TransportFactory.h"
+
+using namespace Cantera;
+
+void printDbl(double val) {
+ if (fabs(val) < 5.0E-17) {
+ cout << " nil";
+ } else {
+ cout << val;
+ }
+}
+
+int main(int argc, char** argv) {
+ int k;
+ string infile = "diamond.xml";
+
+ try {
+
+
+ IdealGasMix g("gri30.xml", "gri30_mix");
+ int nsp = g.nSpecies();
+ double pres = 1.0E5;
+ vector_fp Xset(nsp, 0.0);
+ Xset[0] = 0.269205 ;
+ Xset[1] = 0.000107082;
+ Xset[2] = 1.36377e-09 ;
+ Xset[3] = 4.35475e-10;
+ Xset[4] = 4.34036e-06 ;
+ Xset[5] = 0.192249;
+ Xset[6] = 3.59356e-13;
+ Xset[7] = 2.78061e-12 ;
+ Xset[8] = 4.7406e-18 ;
+ Xset[9] = 4.12955e-17 ;
+ Xset[10] = 2.58549e-14 ;
+ Xset[11] = 8.96502e-16 ;
+ Xset[12] = 6.09056e-11 ;
+ Xset[13] = 7.56752e-09 ;
+ Xset[14] = 0.192253;
+ Xset[15] = 0.0385036;
+ Xset[16] = 1.49596e-08 ;
+ Xset[17] = 2.22378e-08 ;
+ Xset[18] = 1.43096e-13 ;
+ Xset[19] = 1.45312e-15 ;
+ Xset[20] = 1.96948e-12 ;
+ Xset[21] = 8.41937e-19;
+ Xset[22] = 3.18852e-13 ;
+ Xset[23] = 7.93625e-18 ;
+ Xset[24] = 3.20653e-15 ;
+ Xset[25] = 1.15149e-19 ;
+ Xset[26] = 1.61189e-18 ;
+ Xset[27] = 1.4719e-15 ;
+ Xset[28] = 5.24728e-13 ;
+ Xset[29] = 6.90582e-17 ;
+ Xset[30] = 6.37248e-12 ;
+ Xset[31] = 5.93728e-11 ;
+ Xset[32] = 2.71219e-09 ;
+ Xset[33] = 2.66645e-06 ;
+ Xset[34] = 6.57142e-11 ;
+ Xset[35] = 9.52453e-08 ;
+ Xset[36] = 1.26006e-14;
+ Xset[37] = 3.49802e-12;
+ Xset[38] = 1.19232e-11 ;
+ Xset[39] = 7.17782e-13;
+ Xset[40] = 1.85347e-07 ;
+ Xset[41] = 8.25325e-14 ;
+ Xset[42] = 5.00914e-20 ;
+ Xset[43] = 1.54407e-16 ;
+ Xset[44] =3.07176e-11 ;
+ Xset[45] =4.93198e-08 ;
+ Xset[46] =4.84792e-12 ;
+ Xset[47] = 0.307675 ;
+ Xset[48] =0;
+ Xset[49] =6.21649e-29;
+ Xset[50] = 8.42393e-28 ;
+ Xset[51] = 6.77865e-18;
+ Xset[52] = 2.19225e-16;
+ double T1 = 1500.;
+
+ double sum = 0.0;
+ for (k = 0; k < nsp; k++) {
+ sum += Xset[k];
+ }
+ for (k = 0; k < nsp; k++) {
+ Xset[k] /= sum;
+ }
+
+ vector_fp X2set(nsp, 0.0);
+ X2set[0] = 0.25 ;
+ X2set[5] = 0.17;
+ X2set[14] = 0.15;
+ X2set[15] = 0.05;
+ X2set[47] = 0.38 ;
+ double T2 = 1200.;
+
+ double dist = 0.1;
+
+ vector_fp X3set(nsp, 0.0);
+ X3set[0] = 0.27 ;
+ X3set[5] = 0.15;
+ X3set[14] = 0.18;
+ X3set[15] = 0.06;
+ X3set[47] = 0.36 ;
+ double T3 = 1400.;
+
+ vector_fp grad_T(3, 0.0);
+
+ Array2D grad_X(nsp, 2, 0.0);
+
+
+ for( k = 0; k < nsp; k++) {
+ grad_X(k,0) = (X2set[k] - Xset[k])/dist;
+ grad_X(k,1) = (X3set[k] - Xset[k])/dist;
+ }
+
+ grad_T[0] = (T2 - T1) / dist;
+ grad_T[1] = (T3 - T1) / dist;
+
+ int log_level = 0;
+ Transport * tran = newTransportMgr("Multi", &g, log_level=0);
+
+ MultiTransport * tranMix = dynamic_cast(tran);
+
+
+ g.setState_TPX(1500.0, pres, DATA_PTR(Xset));
+
+
+ vector_fp mixDiffs(nsp, 0.0);
+
+ tranMix->getMixDiffCoeffs(DATA_PTR(mixDiffs));
+ printf(" Dump of the mixture Diffusivities:\n");
+ for (k = 0; k < nsp; k++) {
+ string sss = g.speciesName(k);
+ printf(" %15s %13.5g\n", sss.c_str(), mixDiffs[k]);
+ }
+
+
+ vector_fp specVisc(nsp, 0.0);
+
+ tranMix->getSpeciesViscosities(DATA_PTR(specVisc));
+ printf(" Dump of the species viscosities:\n");
+ for (k = 0; k < nsp; k++) {
+ string sss = g.speciesName(k);
+ printf(" %15s %13.5g\n", sss.c_str(), specVisc[k]);
+ }
+
+ vector_fp thermDiff(nsp, 0.0);
+ tranMix->getThermalDiffCoeffs(DATA_PTR(thermDiff));
+ printf(" Dump of the Thermal Diffusivities :\n");
+ for (k = 0; k < nsp; k++) {
+ string sss = g.speciesName(k);
+ printf(" %15s %13.5g\n", sss.c_str(), thermDiff[k]);
+ }
+
+ printf("Viscoscity and thermal Cond vs. T\n");
+ for (k = 0; k < 10; k++) {
+ T1 = 400. + 100. * k;
+ g.setState_TPX(T1, pres, DATA_PTR(Xset));
+ double visc = tran->viscosity();
+ double cond = tran->thermalConductivity();
+ printf(" %13g %13.5g %13.5g\n", T1, visc, cond);
+ }
+
+ g.setState_TPX(T1, pres, DATA_PTR(Xset));
+
+ Array2D Bdiff(nsp, nsp, 0.0);
+ printf("Binary Diffusion Coefficients H2 vs species\n");
+
+ tranMix->getBinaryDiffCoeffs(nsp, Bdiff.ptrColumn(0));
+ for (k = 0; k < nsp; k++) {
+ string sss = g.speciesName(k);
+ printf(" H2 - %15s %13.5g %13.5g\n", sss.c_str(), Bdiff(0,k), Bdiff(k,0));
+ }
+
+
+ vector_fp specMob(nsp, 0.0);
+
+ //tranMix->getMobilities(DATA_PTR(specMob));
+ printf(" Dump of the species mobilities:\n");
+ for (k = 0; k < nsp; k++) {
+ string sss = g.speciesName(k);
+ printf(" %15s %13.5g\n", sss.c_str(), specMob[k]);
+ }
+
+ Array2D fluxes(nsp, 2, 0.0);
+
+ tranMix->getSpeciesFluxes(2, DATA_PTR(grad_T), nsp,
+ grad_X.ptrColumn(0), nsp, fluxes.ptrColumn(0));
+ printf(" Dump of the species fluxes:\n");
+ double sum1 = 0.0;
+ double sum2 = 0.0;
+ double max1 = 0.0;
+ double max2 = 0.0;
+ for (k = 0; k < nsp; k++) {
+ string sss = g.speciesName(k);
+ printf(" %15s %13.5g %13.5g\n", sss.c_str(), fluxes(k,0), fluxes(k,1));
+ sum1 += fluxes(k,0);
+ if (fabs(fluxes(k,0) > max1)) {
+ max1 = fabs(fluxes(k,0));
+ }
+ sum2 += fluxes(k,1);
+ if (fabs(fluxes(k,1) > max2)) {
+ max2 = fabs(fluxes(k,0));
+ }
+ }
+
+ // Make sure roundoff error doesn't interfere with the printout.
+ // these should be zero.
+ if (fabs(sum1) * 1.0E14 > max1) {
+ printf("sum in x direction = %13.5g\n", sum1);
+ } else {
+ printf("sum in x direction = 0\n");
+ }
+ if (fabs(sum2) * 1.0E14 > max2) {
+ printf("sum in y direction = %13.5g\n", sum1);
+ } else {
+ printf("sum in y direction = 0\n");
+ }
+
+
+ Array2D MDdiff(nsp, nsp, 0.0);
+ printf("Multicomponent Diffusion Coefficients H2 vs species\n");
+
+ tranMix->getMultiDiffCoeffs(nsp, MDdiff.ptrColumn(0));
+ for (k = 0; k < nsp; k++) {
+ string sss = g.speciesName(k);
+ printf(" H2 - %15s %13.5g %13.5g\n", sss.c_str(), MDdiff(0,k), MDdiff(k,0));
+ }
+
+
+ }
+ catch (CanteraError) {
+ showErrors(cout);
+ }
+
+ return 0;
+}
+/***********************************************************/
diff --git a/test_problems/multiGasTransport/output_blessed.txt b/test_problems/multiGasTransport/output_blessed.txt
new file mode 100644
index 000000000..b114a2770
--- /dev/null
+++ b/test_problems/multiGasTransport/output_blessed.txt
@@ -0,0 +1,391 @@
+ Dump of the mixture Diffusivities:
+ H2 0.0016117
+ H 0.0022587
+ O 0.00064032
+ O2 0.00042264
+ OH 0.00062946
+ H2O 0.00055527
+ HO2 0.00042019
+ H2O2 0.00041763
+ C 0.00059188
+ CH 0.00068026
+ CH2 0.0004608
+ CH2(S) 0.0004608
+ CH3 0.00045156
+ CH4 0.00044985
+ CO 0.00040272
+ CO2 0.0003319
+ HCO 0.00036192
+ CH2O 0.00035926
+ CH2OH 0.00035027
+ CH3O 0.00035027
+ CH3OH 0.00035149
+ C2H 0.0003524
+ C2H2 0.00034919
+ C2H3 0.00034618
+ C2H4 0.00034634
+ C2H5 0.00031771
+ C2H6 0.00031538
+ HCCO 0.00053082
+ CH2CO 0.00030635
+ HCCOH 0.00030635
+ N 0.00056491
+ NH 0.00067404
+ NH2 0.00066041
+ NH3 0.00050222
+ NNH 0.00040495
+ NO 0.00041226
+ NO2 0.00037026
+ N2O 0.00033509
+ HNO 0.00041903
+ CN 0.00040648
+ HCN 0.00035852
+ H2CN 0.00035559
+ HCNN 0.00053081
+ HCNO 0.00033642
+ HOCN 0.00033642
+ HNCO 0.00033642
+ NCO 0.00033783
+ N2 0.00039204
+ AR 0.00041248
+ C3H7 0.00024676
+ C3H8 0.00024577
+ CH2CHO 0.00030507
+ CH3CHO 0.00030384
+ Dump of the species viscosities:
+ H2 2.5558e-05
+ H 3.012e-05
+ O 7.2846e-05
+ O2 6.232e-05
+ OH 7.5106e-05
+ H2O 5.3252e-05
+ HO2 6.3294e-05
+ H2O2 6.4253e-05
+ C 4.4565e-05
+ CH 6.5712e-05
+ CH2 3.2735e-05
+ CH2(S) 3.2735e-05
+ CH3 3.3891e-05
+ CH4 3.6048e-05
+ CO 5.31e-05
+ CO2 5.4383e-05
+ HCO 4.1657e-05
+ CH2O 4.2374e-05
+ CH2OH 4.1945e-05
+ CH3O 4.1945e-05
+ CH3OH 4.3184e-05
+ C2H 3.5412e-05
+ C2H2 3.6118e-05
+ C2H3 3.6811e-05
+ C2H4 3.7975e-05
+ C2H5 3.3592e-05
+ C2H6 3.4169e-05
+ HCCO 0.00012854
+ CH2CO 4.2391e-05
+ HCCOH 4.2391e-05
+ N 4.8126e-05
+ NH 7.5995e-05
+ NH2 7.8505e-05
+ NH3 4.7175e-05
+ NNH 5.2243e-05
+ NO 5.5922e-05
+ NO2 6.636e-05
+ N2O 5.2858e-05
+ HNO 5.9564e-05
+ CN 4.7597e-05
+ HCN 3.7899e-05
+ H2CN 3.86e-05
+ HCNN 0.00012855
+ HCNO 5.2262e-05
+ HOCN 5.2262e-05
+ HNCO 5.2262e-05
+ NCO 5.1646e-05
+ N2 5.4033e-05
+ AR 7.2525e-05
+ C3H7 3.0191e-05
+ C3H8 3.0542e-05
+ CH2CHO 4.2896e-05
+ CH3CHO 4.3395e-05
+ Dump of the Thermal Diffusivities :
+ H2 -1.7503e-06
+ H -5.7989e-10
+ O -1.0369e-14
+ O2 2.9826e-15
+ OH -2.8782e-11
+ H2O -8.6999e-07
+ HO2 2.9475e-18
+ H2O2 2.4422e-17
+ C -5.3516e-22
+ CH -6.1047e-22
+ CH2 -1.2322e-19
+ CH2(S) -4.3658e-21
+ CH3 -2.61e-16
+ CH4 -3.2329e-14
+ CO 7.5984e-07
+ CO2 7.0425e-07
+ HCO 7.2002e-14
+ CH2O 1.206e-13
+ CH2OH 8.7283e-19
+ CH3O 8.3686e-21
+ CH3OH 1.4224e-17
+ C2H -2.0912e-22
+ C2H2 1.0948e-18
+ C2H3 1.1969e-22
+ C2H4 1.5341e-20
+ C2H5 -1.8899e-22
+ C2H6 8.0324e-23
+ HCCO 1.5491e-20
+ CH2CO 8.4812e-18
+ HCCOH 9.805e-22
+ N -4.407e-17
+ NH -4.9452e-16
+ NH2 -2.0983e-14
+ NH3 -1.208e-11
+ NNH 3.6354e-16
+ NO 5.2094e-13
+ NO2 2.5505e-19
+ N2O 6.5745e-17
+ HNO 7.7863e-17
+ CN 2.1289e-18
+ HCN 6.0686e-13
+ H2CN 3.2947e-19
+ HCNN -1.9632e-21
+ HCNO 2.8188e-21
+ HOCN 5.5133e-16
+ HNCO 8.851e-13
+ NCO 8.2058e-17
+ N2 1.1568e-06
+ AR 1.1368e-22
+ C3H7 4.4615e-23
+ C3H8 -1.5971e-22
+ CH2CHO 3.1949e-22
+ CH3CHO 3.5976e-21
+Viscoscity and thermal Cond vs. T
+ 400 1.9759e-05 0.063366
+ 500 2.3573e-05 0.075886
+ 600 2.7136e-05 0.087831
+ 700 3.0495e-05 0.099704
+ 800 3.3685e-05 0.11176
+ 900 3.6732e-05 0.12387
+ 1000 3.9656e-05 0.13543
+ 1100 4.2474e-05 0.14732
+ 1200 4.5198e-05 0.15911
+ 1300 4.7839e-05 0.1708
+Binary Diffusion Coefficients H2 vs species
+ H2 - H2 0.0016879 0.0016879
+ H2 - H 0.0025721 0.0025721
+ H2 - O 0.0012683 0.0012683
+ H2 - O2 0.00095123 0.00095123
+ H2 - OH 0.0012641 0.0012641
+ H2 - H2O 0.0011339 0.0011339
+ H2 - HO2 0.00095037 0.00095037
+ H2 - H2O2 0.00094956 0.00094956
+ H2 - C 0.0010829 0.0010829
+ H2 - CH 0.0012845 0.0012845
+ H2 - CH2 0.00086916 0.00086916
+ H2 - CH2(S) 0.00086916 0.00086916
+ H2 - CH3 0.00086549 0.00086549
+ H2 - CH4 0.0008765 0.0008765
+ H2 - CO 0.00090717 0.00090717
+ H2 - CO2 0.00080661 0.00080661
+ H2 - HCO 0.00080996 0.00080996
+ H2 - CH2O 0.00080907 0.00080907
+ H2 - CH2OH 0.00079571 0.00079571
+ H2 - CH3O 0.00079571 0.00079571
+ H2 - CH3OH 0.00079987 0.00079987
+ H2 - C2H 0.00075165 0.00075165
+ H2 - C2H2 0.00075057 0.00075057
+ H2 - C2H3 0.00074956 0.00074956
+ H2 - C2H4 0.00075894 0.00075894
+ H2 - C2H5 0.00069633 0.00069633
+ H2 - C2H6 0.00069557 0.00069557
+ H2 - HCCO 0.0012756 0.0012756
+ H2 - CH2CO 0.00072381 0.00072381
+ H2 - HCCOH 0.00072381 0.00072381
+ H2 - N 0.0010717 0.0010717
+ H2 - NH 0.0013191 0.0013191
+ H2 - NH2 0.0013142 0.0013142
+ H2 - NH3 0.001032 0.001032
+ H2 - NNH 0.00088778 0.00088778
+ H2 - NO 0.00091389 0.00091389
+ H2 - NO2 0.00088641 0.00088641
+ H2 - N2O 0.00079306 0.00079306
+ H2 - HNO 0.00093713 0.00093713
+ H2 - CN 0.00087207 0.00087207
+ H2 - HCN 0.00079297 0.00079297
+ H2 - H2CN 0.00079198 0.00079198
+ H2 - HCNN 0.0012756 0.0012756
+ H2 - HCNO 0.00079346 0.00079346
+ H2 - HOCN 0.00079346 0.00079346
+ H2 - HNCO 0.00079346 0.00079346
+ H2 - NCO 0.00079388 0.00079388
+ H2 - N2 0.00091593 0.00091593
+ H2 - AR 0.00096702 0.00096702
+ H2 - C3H7 0.00057286 0.00057286
+ H2 - C3H8 0.00057256 0.00057256
+ H2 - CH2CHO 0.00072342 0.00072342
+ H2 - CH3CHO 0.00072305 0.00072305
+ Dump of the species mobilities:
+ H2 0
+ H 0
+ O 0
+ O2 0
+ OH 0
+ H2O 0
+ HO2 0
+ H2O2 0
+ C 0
+ CH 0
+ CH2 0
+ CH2(S) 0
+ CH3 0
+ CH4 0
+ CO 0
+ CO2 0
+ HCO 0
+ CH2O 0
+ CH2OH 0
+ CH3O 0
+ CH3OH 0
+ C2H 0
+ C2H2 0
+ C2H3 0
+ C2H4 0
+ C2H5 0
+ C2H6 0
+ HCCO 0
+ CH2CO 0
+ HCCOH 0
+ N 0
+ NH 0
+ NH2 0
+ NH3 0
+ NNH 0
+ NO 0
+ NO2 0
+ N2O 0
+ HNO 0
+ CN 0
+ HCN 0
+ H2CN 0
+ HCNN 0
+ HCNO 0
+ HOCN 0
+ HNCO 0
+ NCO 0
+ N2 0
+ AR 0
+ C3H7 0
+ C3H8 0
+ CH2CHO 0
+ CH3CHO 0
+ Dump of the species fluxes:
+ H2 1.1295e-06 -1.0115e-06
+ H 1.675e-08 1.7425e-08
+ O 1.0192e-12 1.0229e-12
+ O2 4.4764e-13 4.3823e-13
+ OH 3.4017e-09 3.4061e-09
+ H2O 1.7507e-05 3.1389e-05
+ HO2 3.7974e-16 3.7115e-16
+ H2O2 3.0116e-15 2.9421e-15
+ C 2.4382e-21 2.464e-21
+ CH 2.6835e-20 2.6825e-20
+ CH2 1.2328e-17 1.232e-17
+ CH2(S) 4.2716e-19 4.2709e-19
+ CH3 3.0594e-14 3.0518e-14
+ CH4 4.0423e-12 4.0311e-12
+ CO 4.2351e-05 1.3798e-05
+ CO2 -9.6117e-06 -2.1996e-05
+ HCO 1.1937e-11 1.1691e-11
+ CH2O 1.8246e-11 1.7856e-11
+ CH2OH 1.1867e-16 1.1612e-16
+ CH3O 1.2045e-18 1.179e-18
+ CH3OH 1.6941e-15 1.6538e-15
+ C2H 8.5585e-22 6.5125e-22
+ C2H2 2.2129e-16 2.1663e-16
+ C2H3 5.884e-21 5.6232e-21
+ C2H4 2.3822e-18 2.3281e-18
+ C2H5 6.223e-22 2.5991e-22
+ C2H6 9.1348e-22 1.0591e-21
+ HCCO 2.4162e-18 2.3733e-18
+ CH2CO 5.2646e-16 5.0816e-16
+ HCCOH 6.9269e-20 6.6872e-20
+ N 3.6829e-15 3.699e-15
+ NH 4.3696e-14 4.3934e-14
+ NH2 2.0916e-12 2.0997e-12
+ NH3 1.6742e-09 1.6732e-09
+ NNH 5.8843e-14 5.7587e-14
+ NO 8.9545e-11 8.7725e-11
+ NO2 1.6614e-17 1.6068e-17
+ N2O 4.0171e-15 3.8758e-15
+ HNO 1.1783e-14 1.1533e-14
+ CN 5.7585e-16 5.6534e-16
+ HCN 1.3605e-10 1.3352e-10
+ H2CN 6.2428e-17 6.12e-17
+ HCNN 1.0244e-20 4.4589e-21
+ HCNO 1.7387e-19 1.6786e-19
+ HOCN 3.4592e-14 3.3394e-14
+ HNCO 5.554e-11 5.3617e-11
+ NCO 5.3473e-15 5.1664e-15
+ N2 -5.1397e-05 -2.2202e-05
+ AR -2.0486e-23 -6.8287e-24
+ C3H7 3.1515e-22 1.0505e-22
+ C3H8 -1.8775e-22 -6.2583e-23
+ CH2CHO 7.4066e-21 6.851e-21
+ CH3CHO 2.2845e-19 2.206e-19
+sum in x direction = 0
+sum in y direction = 0
+Multicomponent Diffusion Coefficients H2 vs species
+ H2 - H2 0 0
+ H2 - H 0.020703 0.017382
+ H2 - O 0.0015341 0.004933
+ H2 - O2 0.00079887 0.0032535
+ H2 - OH 0.0014511 0.0048493
+ H2 - H2O 0.0013647 0.0036314
+ H2 - HO2 0.00077706 0.0032354
+ H2 - H2O2 0.00075651 0.0032157
+ H2 - C 0.0019692 0.0045605
+ H2 - CH 0.0018524 0.0052407
+ H2 - CH2 0.0016827 0.0035457
+ H2 - CH2(S) 0.0016827 0.0035457
+ H2 - CH3 0.0015775 0.0034746
+ H2 - CH4 0.0014868 0.0034605
+ H2 - CO 0.00089568 0.0025486
+ H2 - CO2 0.00059045 0.0024497
+ H2 - HCO 0.00085824 0.0027701
+ H2 - CH2O 0.00083193 0.0027497
+ H2 - CH2OH 0.00080603 0.0026796
+ H2 - CH3O 0.00080603 0.0026796
+ H2 - CH3OH 0.00078349 0.0026908
+ H2 - C2H 0.00097607 0.0027085
+ H2 - C2H2 0.00094124 0.0026838
+ H2 - C2H3 0.00090895 0.0026607
+ H2 - C2H4 0.00088002 0.0026588
+ H2 - C2H5 0.00084597 0.0024401
+ H2 - C2H6 0.00081988 0.0024223
+ H2 - HCCO 0.00066948 0.0040843
+ H2 - CH2CO 0.00060738 0.0023465
+ H2 - HCCOH 0.00060738 0.0023465
+ H2 - N 0.0017083 0.0043527
+ H2 - NH 0.0016308 0.0051928
+ H2 - NH2 0.0015371 0.0050838
+ H2 - NH3 0.0014256 0.0038362
+ H2 - NNH 0.00086567 0.0031201
+ H2 - NO 0.00084253 0.0031742
+ H2 - NO2 0.0005749 0.0028463
+ H2 - N2O 0.00058929 0.0025745
+ H2 - HNO 0.00082014 0.0032259
+ H2 - CN 0.00095394 0.0031317
+ H2 - HCN 0.00091411 0.0027416
+ H2 - H2CN 0.00088394 0.0027192
+ H2 - HCNN 0.00066944 0.0040842
+ H2 - HCNO 0.00060129 0.0025847
+ H2 - HOCN 0.00060129 0.0025847
+ H2 - HNCO 0.00060129 0.0025847
+ H2 - NCO 0.0006141 0.0025956
+ H2 - N2 0.00089645 0.0021797
+ H2 - AR 0.00065799 0.0031743
+ H2 - C3H7 0.0005806 0.0018947
+ H2 - C3H8 0.0005685 0.0018871
+ H2 - CH2CHO 0.00059459 0.0023368
+ H2 - CH3CHO 0.00058238 0.0023274
diff --git a/test_problems/multiGasTransport/runtest b/test_problems/multiGasTransport/runtest
new file mode 100755
index 000000000..984b65564
--- /dev/null
+++ b/test_problems/multiGasTransport/runtest
@@ -0,0 +1,34 @@
+#!/bin/sh
+#
+#
+
+temp_success="1"
+/bin/rm -f output.txt outputa.txt
+tname="multiGasTransport"
+
+#################################################################
+#
+#################################################################
+CANTERA_DATA=${CANTERA_DATA:=../../data/inputs}; export CANTERA_DATA
+
+CANTERA_BIN=${CANTERA_BIN:=../../bin}
+./multiGasTransport > output.txt
+retnStat=$?
+if [ $retnStat != "0" ]
+then
+ temp_success="0"
+ echo "$tname ($tname test) returned with bad status, $retnStat, check output"
+fi
+
+../../bin/exp3to2.sh output.txt > outputa.txt
+diff -w outputa.txt output_blessed.txt > diff_test.out
+retnStat=$?
+if [ $retnStat = "0" ]
+then
+ echo "successful diff comparison on $tname test"
+else
+ echo "unsuccessful diff comparison on $tname test"
+ echo "FAILED" > csvCode.txt
+ temp_success="0"
+fi
+