c     full N2/O2/H2O/CO2 model; March 1994

 

c symbol  energy    yinit      MolWt    StatWt   Csubv  ion_Z   Q_flag

 

e          0.00    0.             0       1.       1.5    -1       F

 

N2         0.00    0.79          28       1.       2.5     0       T

N2v        0.29    0.            28       1.       2.5     0       F

N2A        6.17    0.0           28       1.       2.5     0       T

N2a        8.40    0.0           28       1.       2.5     0       T

N2+       15.60    0.0           28       1.       2.5    +1       F

N4+       15.60    0.0           56       1.       2.5    +1       F

 

O2         0.00    0.21          32       1.       2.5     0       T

O2v        0.00    0.0           32       1.       2.5     0       F

O2a1D      0.98    0.0           32       1.       2.5     0       T

O2B1S      1.63    0.0           32       1.       2.5     0       T

O2+       12.06    0.0           32       1.       2.5    +1       F

O4+       12.06    0.0           64       1.       2.5    +1       F

O2-       -0.43    0.0           32       1.       2.5    -1       F

O          5.15    0.0           16       1.       1.5     0       T

O1D        7.30    0.0           16       1.       1.5     0       F

O1S        9.10    0.0           16       1.       1.5     0       F

O+        13.66    0.0           16       1.       1.5    +1       F

O-         3.70    0.0           16       1.       1.5    -1       F

O3         1.51    0.0           48       1.       2.5     0       T

O3-       -0.60    0.0           48       1.       2.5    -1       F

O3+       14.31    0.0           48       1.       2.5    +1       F

O4-        0.      0.0           64       1.       2.5    -1       F

 

N          9.75    0.0           14       1.       1.5     0       F

NO         0.93    0.0           30       1.       2.5     0       F

NO+        9.28    0.0           30       1.       2.5    +1       F

NO-        0.91    0.0           30       1.       2.5    -1       F

NO2        0.37    0.0           46       1.       2.5     0       F

NO2-      -2.10    0.0           46       1.       2.5    -1       F

NO3        0.74    0.0           62       1.       2.5     0       F

NO3-      -2.00    0.0           62       1.       2.5    -1       F

N2O        0.88    0.0           44       1.       2.5     0       T

N2O3       0.86    0.0           76       1.       2.5     0       F

 

H2O       -2.51    0.025         18       1.       2.5     0       T

H          4.48    0.0            1       1.       1.5     0       F

H-         1.49    0.0            1       1.       1.5    -1       F

OH         5.12    0.0           17       1.       2.5     0       F

OH-       -1.43    0.0           17       1.       2.5    -1       F

H2         0.00    0.0            2       1.       2.5     0       F

H2O+      12.62    0.0           18       1.       2.5    +1       F

H3O+       4.80    0.0           19       1.       2.5    +1       F

OH+       12.94    0.0           17       1.       2.5    +1       F

HO2        0.217   0.0           33       1.       2.5     0       F

H2O2      -1.41    0.0           34       1.       2.5     0       F

H2O2-      2.9     0.0           34       1.       2.5    -1       F

H2O3-     -1.23    0.0           50       1.       2.5    -1       F

H2O4-     -1.4     0.0           66       1.       2.5    -1       F

H3O2-     -2.50    0.0           35       1.       2.5    -1       F

 

NO-w       0.28    0.0           48       1.       2.5    -1       F

NO2-w     -2.76    0.0           64       1.       2.5    -1       F

NH         0.00    0.0           15       1.       2.5     0       F

NH2        0.00    0.0           16       1.       2.5     0       F

HNO       -0.50    0.0           31       1.       2.5     0       F

HNO2      -0.79    0.0           47       1.       2.5     0       F

HNO3      -1.40    0.0           63       1.       2.5     0       F

 

CO2        -4.06      0.00       44       1.0     3.5     0       T

CO2v       -3.977     0.         44       1.0     3.5     0       F

CO         -1.18      0.         28       1.0     2.5     0       F

CO3-        0.        0.         60       1.0     2.5    -1       F

CO4-        0.        0.         76       1.0     2.5    -1       F

CN          0.        0.         26       1.0     2.5     0       F

HCO         0.        0.         29       1.0     2.5     0       F

 

Ar          0.0       0.0        40       1.0     1.5     0       T

 

End_List /

 

 

c   Begining of Air Chemistry:

 

c   Electron Processes:

 

c     Processes involving solution of Boltzmann's eqn:

 

Boltz                                                                    /

       1 N2    + 1 e              -> 1 N2A   + 1 e                       /

  N2   N2A                                                               /

Boltz                                                                    /

       1 N2    + 1 e              -> 1 N2a   + 1 e                       /

  N2   N2a                                                               /

Boltz                                                                    /

       1 N2    + 1 e              -> 1 N2+   + 2 e                       /

  N2   N2+                                                               /

Boltz                                                                    /

       1 O2    + 1 e              -> 1 O2+   + 2 e                       /

  O2   O2+                                                               /

 Boltz                                                                    /

       1 O2    + 1 e              -> 1 O2a1D + 1 e                       /

  O2   O2a1D                                                             /

 Boltz                                                                    /

       1 O2    + 1 e              -> 1 O2B1S + 1 e                       /

  O2   O2B1S                                                             /

Boltz                                                                    /

       1 O2    + 1 e              -> 1 O     + 1 O     + 1 e             /

  O2   O+O                                                               /

Boltz                                                                    /

       1 O2    + 1 e              -> 1 O-    + 1 O                       /

  O2   O+O-                                                              /

Boltz                                                                    /

       1 O2    + 1 e              -> 1 O2-                               /

  O2   O2-                                                               /

Boltz                                                                    /

       1 O     + 1 e              -> 1 O+    + 2 e                       /

  O    O+                                                                /

Boltz                                                                    /

       1 O     + 1 e              -> 1 O1D   + 1 e                       /

  O    O1D                                                               /

Boltz                                                                    /

       1 O     + 1 e              -> 1 O1S   + 1 e                       /

  O    O1S                                                               /

Boltz                                                                    /

       1 N2a   + 1 e              -> 1 N2+   + 2 e                       /

  N2a  N2+                                                               /

Boltz                                                                    /

       1 N2A   + 1 e              -> 1 N2+   + 2 e                       /

  N2A  N2+                                                               /

Boltz                                                                    /

       1 O2a1D + 1 e              -> 1 O     + 1 O     + 1 e             /

  O2a1D  O+O                                                               /

Boltz                                                                    /

       1 O2a1D + 1 e              -> 1 O2+   + 2 e                       /

  O2a1D  O2+                                                               /

Boltz                                                                    /

       1 O2B1S + 1 e              -> 1 O     + 1 O     + 1 e             /

  O2B1S  O+O                                                               /

Boltz                                                                    /

       1 O2B1S + 1 e              -> 1 O2+   + 2 e                       /

  O2B1S  O2+                                                               /

Boltz                                                                    /

       1 N2O   + 1 e              -> 1 N2    + 1 O-                      /

  N2O  N2+O-                                                             /

Boltz                                                                    /

       1 O3    + 1 e              -> 1 O3+   + 2 e                       /

  O3   O3+                                                               /

Boltz                                                                    /

       1 H2O   + 1 e              -> 1 H     + 1 OH    + 1 e             /

  H2O  H+OH                                                              /

Boltz                                                                    /

       1 H2O   + 1 e              -> 1 O1D   + 1 H2    + 1 e             /

  H2O  O*+H2                                                             /

Boltz                                                                    /

       1 H2O   + 1 e              -> 1 H2O+  + 2 e                       /

  H2O  H2O+                                                              /

Boltz                                                                    /

       1 H2O   + 1 e              -> 1 OH-   + 1 H                       /

  H2O  OH-+H                                                             /

Boltz                                                                    /

       1 H2O   + 1 e              -> 1 H-    + 1 OH                      /

  H2O  H-+OH                                                             /

Boltz                                                                    /

       1 H2O   + 1 e              -> 1 H2    + 1 O-                      /

  H2O  H2+O-                                                             /

 

c   **********************************************************************

 

c     Electron "temperature" dependent processes:                        /

 

c     Recombination:

 

Etemp                                                                    /

       1 e     + 1 N2+            -> 1 N     + 1 N                       /

 5.400e-08     -0.39         / 2.2e-7 @ 300K  Biondi (76)

Etemp

       1 e     + 1 N2+   + 1 O2   -> 1 N2    + 1 O2                      /

 1.000e-26                                                               /

Etemp                                                                    /

       1 e     + 1 O2+            -> 1 O     + 1 O                       /

 2.700e-08     -0.56         / 2.1e-7 @ 300K  Biondi (76)

Etemp                                                                    /

       1 e     + 1 O2+            -> 1 O     + 1 O1D                     /

 1.950e-07                                                               /

Etemp

       1 e     + 1 O2+   + 1 O2   -> 1 O2    + 1 O2                      /

 8.000e-29                                                               /

Etemp                                                                    /

       1 e     + 1 NO+            -> 1 N     + 1 O                       /

 6.600e-08     -0.5          / 4.1e-7 @ 300K  Biondi (76)

Etemp                                                                    /

       1 e     + 1 NO+   + 1 O2   -> 1 NO    + 1 O2                      /

 3.100e-23     -1.5                                                      /

Etemp                                                                    /

       1 e     + 1 N4+            -> 1 N2    + 1 N     + 1 N             /

 2.000e-06                                                               /

Etemp                                                                    /

       1 e     + 1 O4+            -> 1 O2    + 1 O     + 1 O             /

 2.000e-06                                                               /

Etemp                                                                    /

       1 e     + 1 O4+            -> 1 O2    + 1 O2                      /

 1.100e-07                                                               /

Etemp                                                                    /

       1 e     + 1 O+    + 1 e    -> 1 O     + 1 e                       /

 8.750e-27     -4.5          / CRR

Etemp                                                                    /

       1 e     + 1 O+    + 1 N2   -> 1 O     + 1 N2                      /

 5.600e-27     -4.5          / CRR

Etemp                                                                    /

       1 e     + 1 O+    + 1 O2   -> 1 O     + 1 O2                      /

 5.600e-27     -4.5          / CRR

Etemp                                                                    /

       1 e     + 1 H2O+           -> 1 H     + 1 OH                      /

 1.100e-06     -0.5          / 6.6e-6 @ 300K

Etemp                                                                    /

       1 e     + 1 H2O+           -> 1 O     + 1 H2                      /

 3.800e-07     -0.5          / 2.4e-6 @ 300K

Etemp                                                                    /

       1 e     + 1 H2O+           -> 1 O     + 1 H     + 1 H             /

 4.800e-07     -0.5          / 3.0e-6 @ 300K

Etemp                                                                    /

       1 e     + 1 H3O+           -> 1 H2O   + 1 H                       /

 2.200e-06    -0.08          / 3.0e-6 @ 300K  Biondi (82) value for H3O+*(H2O)2

 

c     Attachment:

 

Etemp                                                                    /

       1 e     + 1 O2    + 1 O2   -> 1 O2-   + 1 O2                      /

 2.200e-30                                                               /

Etemp

       1 e     + 1 O2    + 1 N2   -> 1 O2-   + 1 N2                      /

 1.000e-31                                            / K92 (#48)

Etemp

       1 e     + 1 O     + 1 O2   -> 1 O-    + 1 O2                      /

 1.000e-31                                                               /

Etemp

       1 e     + 1 O     + 1 N2   -> 1 O-    + 1 N2                      /

 1.000e-31                                                               /

c Etemp

c      1 e     + 1 HO2            -> 1 H     + 1 O2-                     /

c 5.000e-09                                                               /

Etemp

       1 e     + 1 NO2            -> 1 O-    + 1 NO                      /

 3.400e-10    -2.4      3.        / McDaniel, V. IV, p. 1472-1473

Etemp

       1 e     + 1 NO2            -> 1 NO2-                              /

 4.000e-11                        / McDaniel, V. IV, p. 1472-1473

Etemp

       1 e     + 1 O3             -> 1 O-    + 1 O2                      /

 1.000e-11                                                               /

c Etemp

c      1 e     + 1 O              -> 1 O-                                /

c 1.300e-15                                                               /

Etemp

       1 e     + 1 O3    + 1 O2   -> 1 O3-   + 1 O2                      /

 4.600e-28                                                               /

Etemp

       1 e     + 1 NO             -> 1 O-    + 1 N                       /

 3.400e-06    -8.2      15.2      / McDaniel, V. IV, p. 1472-1473

Etemp

       1 e     + 1 NO    + 1 N2   -> 1 NO-   + 1 N2                      /

 4.000e-29                   / Smirnov, p. 117; k=4x10^-11 for [N2]=10^18

Etemp

       1 e     + 1 HNO2           -> 1 NO2-  + 1 H                       /

 5.000e-08                        / McDaniel, V. IV, p. 1472-1473

Etemp

       1 e     + 1 HNO3           -> 1 NO2-  + 1 OH                      /

 5.000e-08                        / McDaniel, V. IV, p. 1472-1473

 

c Etemp

c      1 e     + 1 N2O   + 1 N2   -> 1 N2O-  + 1 N2                      /

c 0.030e-31                  / Smirnov, p. 117

 

c     Dissociation:

 

Etemp

       1 e     + 1 O3             -> 1 O2    + 1 O     + 1 e             /

 2.240e-08                                                               /

 

c   **********************************************************************

 

c     Atomic & Molecular Reactions:  Neutral Chemistry

 

Chem

       1 O     + 1 O     + 1 N2   -> 1 O2    + 1 N2                      /

 6.498e-35    0.  -1039.     / NIST fit 196-5000 K

c                              K92 (#91): 2.76e-34   0.  -720.

Chem

       1 O     + 1 O     + 1 N    -> 1 O2    + 1 N                       /

 6.498e-35    0.  -1039.     / use the rate for M = N2

Chem

       1 O     + 1 O2    + 1 O2   -> 1 O3    + 1 O2                      /

 2.413e-34    -1.029    -238.9         / NIST fit 80-3000 K; K92 (#95) has

c                                        6.9e-34  -1.25  0.0

Chem

       1 O     + 1 O2    + 1 N2   -> 1 O3    + 1 N2                      /

 2.413e-34    -1.029    -238.9         / NIST fit 80-3000 K; K92 (#94) has

c                                        6.2e-34  -2.0   0.0

Chem

       1 O     + 1 O2    + 1 O3   -> 1 O3    + 1 O3                      /

 1.430e-33    -2.                                     / SGG87

Chem

       1 O     + 1 O2    + 1 O    -> 1 O3    + 1 O                       /

 2.150e-34    0.        -345.                         / SGG87

Chem

       1 O     + 1 O3             -> 2 O2                                /

 1.529e-11    0.   2185.     / NIST fit 197-2000 K

c                              K92 (#82): 2.0e-11   0.  -2300.

Chem

       1 O     + 1 NO    + 1 N2   -> 1 NO2   + 1 N2                      /

 1.064e-31   -1.682     46.26     / NIST fit 200-3000 K; see also K92 (#96)

Chem

       1 O     + 1 NO    + 1 O2   -> 1 NO2   + 1 O2                      /

 1.064e-31   -1.682     46.26     / NIST fit 200-3000 K; see also K92 (#96)

Chem

       1 O     + 1 NO             -> 1 NO2                               /

 2.221e-11    0.459          -92.64    / NIST fit 200-1500 K

Chem

       1 O     + 1 NO             -> 1 O2    + 1 N                       /

 4.222e-11    0.0            23200.    / NIST fit 1500-5000 K

Chem

       1 O     + 1 NO    + 1 N2   -> 1 NO2   + 1 N2                      /

 1.064e-31    -1.682         46.26     / NIST fit 200-3000 K

Chem

       1 O     + 1 NO2            -> 1 O2    + 1 NO                      /

 9.090e-12    0.18                                    / K92 (#81)

c Chem

c      1 O     + 1 NO2            -> 1 NO3                               /

c 2.200e-11                                            / NIST fit; 200-400 K

Chem

       1 O     + 1 NO2   + 1 N2   -> 1 NO3   + 1 N2                      /

 1.065e-31  -2.157      46.59                         / NIST fit; 200-400 K

Chem

       1 O     + 1 NO2   + 1 O2   -> 1 NO3   + 1 O2                      /

 1.065e-31    -2.157    46.59     / NIST fit 200-400 K; see K92 (#97)

Chem

       1 O     + 1 NO2   + 1 N2   -> 1 NO3   + 1 N2                      /

 1.065e-31    -2.157    46.59     / NIST fit 200-400 K; see K92 (#97)

Chem

       1 O     + 1 NO3            -> 1 O2    + 1 NO2                     /

 1.000e-11                                            / K92 (#83); NIST

 

c                           ---------------

 

Chem

       1 N     + 1 N     + 1 N2   -> 1 N2    + 1 N2                      /

 8.270e-34    0.        -500.                         / K92 (#90)

c     NIST: ref 91PRA/SMI has k = 4.1e-34, 8.6e-34, 1.1e-33 for

c     M = He, Ar, Xe respectively @ 293 K

Chem

       1 N     + 1 N     + 1 N    -> 1 N2    + 1 N                       /

23.320e-34    0.        -500.          / use rate coefficient for M = N2

c     but multiplied by 2.82 to reflect the measurement of 1.25e-32

c     by ref 88KNI/RUB listed in the NIST database

Chem

       1 N     + 1 NO             -> 1 N2    + 1 O                       /

 3.513e-11    0.        49.84          / NIST fit 196-3000 K; see K92 (#76)

Chem

       1 N     + 1 O2             -> 1 NO    + 1 O                       /

 1.001e-11    0.        3473.          / NIST fit 200-1000 K; see K92 (#74)

Chem

       1 N     + 1 NO2            -> 1 N2O   + 1 O                       /

 3.000e-12                                            / K92 (#79); NIST too

Chem

       1 N     + 1 O3             -> 1 NO    + 1 O2                      /

 1.000e-16                                  / NIST; K92 (#75) has k <= 2.e-16

 

c                           ---------------

 

Chem

       1 NO    + 1 O3             -> 1 O2    + 1 NO2                     /

 4.300e-12    0.        1560.                         / K92 (#85)

c     the 195-500 K fit from the NIST database is 2.445e-12   0.   1446.

Chem

       1 NO2   + 1 O3             -> 1 NO3   + 1 O2                      /

 1.893e-13    0.        2542.     / NIST fit 200-363 K; K92 (#87) has

Chem

       1 NO3   + 1 O3             -> 2 O2    + 1 NO2                     /

 1.000e-17                                            / NIST

c                                   1.2e-13  0.  2450.

 

c                           ---------------

 

Chem

       1 NO    + 1 NO2   + 1 N2   -> 1 N2O3  + 1 N2                      /

 9.110e-33                                            / NIST

c Chem

c      1 NO    + 1 NO2            -> 1 N2O3                              /

c 3.400e-12                                            / NIST

Chem

       1 NO    + 1 NO3            -> 2 NO2                               /

 1.113e-11    0.        -220.9    / NIST fit 200-1100 K; K92 (#86) has 1.7e-11

 

 

c ------------------- Humid Air Chemistry Starts Here ---------------------

 

c     Neutral Chemistry:

 

Chem

       1 H     + 1 O2             -> 1 O     + 1 OH                      /

 1.168e-10    0.2789    7860.                         / NIST fit 250-5300 K

Chem

       1 H     + 1 O2    + 1 H2   -> 1 HO2   + 1 H2                      /

 5.790e-32    -0.8      0.                       / NIST (84WAR) 300-2500 K

Chem

       1 H     + 1 O2    + 1 N2   -> 1 HO2   + 1 N2                      /

 5.940e-32    -1.0      0.                       / NIST (86TSA/HAM) 300-2500 K

Chem

       1 H     + 1 O2    + 1 O2   -> 1 HO2   + 1 O2                      /

 5.940e-32    -1.0      0.                  / NIST use rate coeff for M = N2

c     note that the rate coefficient for M = Ar is lower: 2.032e-32  -0.8  0.

Chem

       1 H     + 1 OH    + 1 N2   -> 1 H2O   + 1 N2                      /

 6.880e-31    -2.       0.                       / NIST (86TSA/HAM) 300-3000 K

Chem

       1 H     + 1 OH    + 1 O2   -> 1 H2O   + 1 O2                      /

 6.880e-31    -2.       0.                            / use value for M = N2

Chem

       1 H     + 1 OH    + 1 H2O  -> 1 H2O   + 1 H2O                     /

 4.360e-30    -2.       0.                       / NIST (84WAR) 1000-3000 K

Chem

       1 H     + 1 NO2            -> 1 NO    + 1 OH                      /

 2.200e-10    0.        182.                     / NIST (91KO/FON) 296-760 K

Chem

       1 H     + 1 O3             -> 1 O2    + 1 OH                      /

 7.788e-11    0.2551    327.8                    / NIST fit 196-2000 K

Chem

       1 H     + 1 O3             -> 1 HO2   + 1 O                       /

 7.500e-13                                  / NIST (79FIN/KLE); k <= 7.5e-13

Chem

       1 H     + 1 HO2            -> 1 H2    + 1 O2                      /

 2.571e-11    0.5598    346.                          / NIST fit 245-2500 K

Chem

       1 H     + 1 HO2            -> 1 OH    + 1 OH                      /

 2.356e-10    0.        373.7                         / NIST fit 245-2500 K

Chem

       1 H     + 1 HO2            -> 1 H2O   + 1 O                       /

 9.180e-11    0.        971.9                         / NIST fit 245-773 K

c Chem

c      1 H     + 1 O2             -> 1 HO2                               /

c 7.500e-11                                            / NIST (87DEM/GOL)

c Chem

c      1 H     + 1 OH             -> 1 H2O                               /

c 2.700e-14         / NIST (77ZEL/ERL) @ 300 K; (72FRI/SUT) has 7.3e-14 @ 2130 K

Chem

       1 H     + 1 HNO            -> 1 H2    + 1 NO                      /

 4.270e-12    0.        -998.1                        / NIST fit 295-2100 K

Chem

       1 H     + 1 HNO            -> 1 OH    + 1 NH                      /

 2.410e-9    -0.5        9010.                        / NIST fit 359-3000 K

Chem

       1 H     + 1 HNO            -> 1 O     + 1 NH2                     /

 1.050e-9    -0.3        14730.                  / NIST (91COH/WES) 550-3000 K

Chem

       1 H     + 1 NO             -> 1 NH    + 1 O                       /

 9.290e-10    -0.10     35220.                   / NIST (91COH/WES) 1300-3000 K

Chem

       1 H     + 1 NO             -> 1 OH    + 1 N                       /

 2.111e-10    0.0       24330.                   / NIST fit 1750-4500 K

Chem

       1 H     + 1 NO    + 1 N2   -> 1 HNO   + 1 N2                      /

 7.327e-32    -1.318    184.3                    / NIST fit 231-704 K

Chem

       1 H     + 1 NO    + 1 O2   -> 1 HNO   + 1 O2                      /

 7.327e-32    -1.318    184.3                    / NIST fit 231-704 K

Chem

       1 H     + 1 NO3            -> 1 NO2   + 1 OH                      /

 1.100e-10                                            / NIST (88BOO/CAN)

Chem

       1 H     + 1 H2O2           -> 1 OH    + 1 H2O                     /

 4.000e-11    0.        2000.                    / NIST (86TSA/HAM) 300-2500 K

Chem

       1 H     + 1 H2O2           -> 1 H2    + 1 HO2                     /

 8.000e-11    0.        4000.                    / NIST (86TSA/HAM) 300-2500 K

 

c                           ---------------

 

Chem

       1 OH    + 1 OH             -> 1 H2O   + 1 O                       /

 1.549e-13    1.408     -267.3                        / NIST fit 200-2500 K

Chem

       1 OH    + 1 O              -> 1 O2    + 1 H                       /

 2.105e-11    -0.186    153.9                         / NIST fit 200-5000 K

Chem

       1 OH    + 1 H              -> 1 H2    + 1 O                       /

 1.123e-14    3.406     1233.                         / NIST fit 298-2500 K

Chem

       1 OH    + 1 H2             -> 1 H2O   + 1 H                       /

 2.313e-12    1.47      1761.                         / NIST fit 200-3000 K

Chem

       1 OH    + 1 O3             -> 1 HO2   + 1 O2                      /

 1.472e-12    0.        932.7                         / NIST fit 200-450 K

Chem

       1 OH    + 1 HO2            -> 1 H2O   + 1 O2                      /

 4.381e-11    0.        -110.9                        / NIST fit 200-2550 K

Chem

       1 OH    + 1 OH    + 1 N2   -> 1 H2O2  + 1 N2                      /

 6.050e-31    -3.       0.   / NIST (86TSA/HAM) 300-2500 K; the general fit

c                              is 1.543e-31  -2.021  -183.6 over 200-2500 K

Chem

       1 OH    + 1 OH    + 1 O2   -> 1 H2O2  + 1 O2                      /

 6.050e-31    -3.       0.   / NIST (86TSA/HAM) 300-2500 K; same as M = N2

Chem

       1 OH    + 1 OH    + 1 H2O  -> 1 H2O2  + 1 H2O                     /

 1.543e-31    -2.021    -183.6    / use general fit from NIST;

c                                   NIST ref 88ZEL/EWI have 4.e-30 at 300 K

Chem

       1 OH    + 1 H2O2           -> 1 H2O   + 1 HO2                     /

 4.529e-12    0.        288.9                         / NIST fit 200-2500 K

Chem

       1 OH    + 1 HNO2           -> 1 H2O   + 1 NO2                     /

 1.800e-11    0.        390.                     / NIST (89ATK/BAU) 280-430 K

Chem

       1 OH    + 1 N2O            -> 1 HO2   + 1 N2                      /

 3.696e-13    0.        2740.                         / NIST fit 298-2700 K

c Chem

c      1 OH    + 1 OH             -> 1 H2O2                              /

c 1.510e-11    -0.37     0.                       / NIST (87BRO/COB) 200-1500 K

Chem

       1 OH    + 1 NO    + 1 N2   -> 1 HNO2  + 1 N2                      /

 3.924e-32    0.        -794.2                        / NIST fit 200-505 K

Chem

       1 OH    + 1 NO    + 1 O2   -> 1 HNO2  + 1 O2                      /

 3.924e-32    0.        -794.2                        / NIST fit 200-505 K

Chem

       1 OH    + 1 NO2            -> 1 HO2   + 1 NO                      /

 3.300e-11    0.        3360.                    / NIST (80HOW) 452-1115 K

Chem

       1 OH    + 1 NO2   + 1 N2   -> 1 HNO3  + 1 N2                      /

 8.378e-30    -3.878    409.3                         / NIST fit 200-1200 K

Chem

       1 OH    + 1 NO2   + 1 O2   -> 1 HNO3  + 1 O2                      /

 8.378e-30    -3.878    409.3                         / NIST fit 200-1200 K

Chem

       1 OH    + 1 NO3            -> 1 HO2   + 1 NO2                     /

 2.300e-11                                            / NIST (89ATK/BAU)

Chem

       1 OH    + 1 HNO            -> 1 H2O   + 1 NO                      /

 1.266e-11    0.9904    334.2                         / NIST fit 298-4000 K

Chem

       1 OH    + 1 HNO3           -> 1 H2O   + 1 NO3                     /

 4.006e-14    0.        -317.6                        / NIST fit 200-1100 K

 

c                           ---------------

 

Chem

       1 HO2   + 1 O3             -> 1 OH    + 2 O2                      /

 1.752e-15    0.        -628.3                        / NIST fit 200-413 K

Chem

       1 HO2   + 1 HO2            -> 1 H2O2  + 1 O2                      /

 3.000e-12                                  / NIST (86TSA/HAM) 300-2500 K

Chem

       1 HO2   + 1 O              -> 1 OH    + 1 O2                      /

 2.900e-11    0.        -200.                    / NIST (86TSA/HAM) 300-2500 K

Chem

       1 HO2   + 1 NO             -> 1 OH    + 1 NO2                     /

 3.600e-12    0.        -240.                    / NIST (89ATK/BAU) 230-500 K

c                                                  & (84HAN/SAL) 1000-2000 K

Chem

       2 HO2   + 1 N2             -> 1 H2O2  + 1 O2    + 1 N2            /

 1.900e-33    0.        -980.                    / NIST (89ATK/BAU) 230-420 K

Chem

       1 HO2   + 1 HO2   + 1 O2   -> 1 H2O2  + 2 O2                      /

 1.900e-33    0.        -980.                    / use rate coeff for M = N2

Chem

       1 HO2   + 1 NO             -> 1 O2    + 1 HNO                     /

 9.100e-19    0.        -2819.                   / NIST (79HOW) 271-303 K

Chem

       1 HO2   + 1 NO             -> 1 OH    + 1 NO2                     /

 3.500e-12    0.        -240.                    / NIST (89ATK/BAU) 230-2000 K

Chem

       1 HO2   + 1 NO2            -> 1 HNO2  + 1 O2                      /

 1.200e-13                                       / NIST (75COX)

c Chem

c      1 HO2   + 1 NO             -> 1 HNO3                              /

c 1.400e-13                                            / NIST (75COX/DER)

Chem

       1 HO2   + 1 N              -> 1 OH    + 1 NO                      /

 2.200e-11                                       / NIST (83BRU/SCH2); 1 entry

Chem

       1 HO2   + 1 NO3            -> 1 HNO3  + 1 O2                      /

 9.210e-13              / NIST; for O2 + prod on RHS, k=4.3e-12 (89ATK/BAU)

 

c                           ---------------

 

Chem

       1 N     + 1 OH             -> 1 NO    + 1 H                       /

 3.917e-11    0.        -72.36                        / NIST fit 250-515 K

Chem

       1 N     + 1 OH             -> 1 O     + 1 NH                      /

 1.880e-11    0.1       10700.                   / NIST (91COH/WES) 500-3000 K

Chem

       1 O     + 1 H2             -> 1 OH    + 1 H                       /

 1.501e-13    2.844     2834.                         / NIST fit 293-3532 K

Chem

       1 O     + 1 H2O2           -> 1 OH    + 1 HO2                     /

 1.792e-13    2.919     1394.                         / NIST fit 200-2500 K

Chem

       1 N2O3  + 1 H2O            -> 2 HNO2                              /

 6.300e-11    0.        4468.                    / NIST (75ENG/COR) 298-323 K

Chem

       1 HNO2  + 1 O              -> 1 OH    + 1 NO2                     /

 1.000e-15                                  / NIST (78KAI/JAP2) k <= 1.e-15

Chem

       1 HNO3  + 1 O              -> 1 OH    + 1 NO3                     /

 3.000e-17                                            / NIST; k<= 3.e-17

Chem

       1 HNO2  + 1 NO3            -> 1 HNO3  + 1 NO2                     /

 2.000e-15                                       / NIST (1 entry); k<= 2.e-15

Chem

       1 H2O2  + 1 NO3            -> 1 HO2   + 1 HNO3                    /

 2.000e-15                                       / NIST (1 entry); k<= 2.e-15

 

 

c     Excited State Chemistry:

 

Chem

       1 N2A   + 1 H2O            -> 1 H2    + 1 N     + 1 NO            /

 1.000e-10                                                               /

 

Chem

       1 N2a   + 1 H2O            -> 1 H2    + 1 N     + 1 NO            /

 1.000e-10                                                               /

 

c                           ---------------

 

Chem

       1 O1D   + 1 H2O            -> 1 OH    + 1 OH                      /

 2.000e-10                                            / A89

Chem

       1 O1D   + 1 H2             -> 1 OH    + 1 H                       /

 1.000e-10                                  / NIST; no T dependence 200-350 K

Chem

       1 O1D   + 1 H2O            -> 1 H2    + 1 O2                      /

 2.300e-10                                            / NIST

Chem

       1 O1D   + 1 H2O2           -> 1 H2O   + 1 O2                      /

 5.200e-10                                            / NIST (76FLE/HUS)

 

c                           ---------------

 

Chem

       1 O1S   + 1 H2O            -> 1 O     + 1 H2O                     /

 3.000e-10                                            / S&B78

Chem

       1 O1S   + 1 H2O            -> 1 OH    + 1 OH                      /

 5.000e-10                                            / S&B78

Chem

       1 O1S   + 1 H2O            -> 1 H2    + 1 O2                      /

 5.000e-10                                            / S&B78

 

c                           ---------------

 

Chem

       1 O2a1D + 1 H2O            -> 1 O2    + 1 H2O                     /

 5.000e-18                                                               /

 

Chem

       1 O2B1S + 1 H2O            -> 1 O2    + 1 H2O                     /

 4.000e-12                                                               /

 

 

c     Ion - Molecule:

 

c       Positive Ion

 

Chem

       1 O+    + 1 H2             -> 1 OH+   + 1 H                       /

 1.000e-10                                            / A93

Chem

       1 O+    + 1 H2O            -> 1 H2O+  + 1 O                       /

 2.600e-09                                            / A93

 

Chem

       1 O2+   + 2 H2O            -> 1 H3O+  + 1 OH    + 1 O2            /

 2.000e-28                                                               /

 

Chem

       1 O4+   + 2 H2O            -> 1 H3O+  + 1 OH    + 2 O2            /

 2.000e-28                                                               /

 

Chem

       1 N2+   + 1 H2O            -> 1 H2O+  + 1 N2                      /

 2.200e-09                                            / A93

 

Chem

       1 H2O+  + 1 O2             -> 1 H2O   + 1 O2+                     /

 3.300e-10                                            / A93

Chem

       1 H2O+  + 1 H2O            -> 1 H3O+  + 1 OH                      /

 1.850e-09                                            / A93

 

Chem

       1 OH+   + 1 O2             -> 1 OH    + 1 O2+                     /

 3.800e-10                                            / A93

 

Chem

       1 NO+   + 2 H2O            -> 1 H3O+  + 1 HNO2                    /

 2.000e-28                                                               /

 

 

c       Negative Ion

 

Chem

       1 O-    + 1 H2             -> 1 H2O   + 1 e                       /

 6.500e-10                                                               /

 

Chem

       1 O2-   + 1 H2O            -> 1 O2    + 1 H2O   + 1 e             /

 5.000e-9     0.        5000.                         / DNA (10-7)

 

Chem

       1 OH-   + 1 O3             -> 1 OH    + 1 O3-                     /

 5.000e-10                                                               /

Chem

       1 OH-   + 1 O3             -> 1 O2-   + 1 HO2                     /

 1.000e-11                                                               /

 

Chem

       1 H-    + 1 H2O            -> 1 OH-   + 1 H2                      /

 1.000e-09                                                               /

 

 

c     Ionic Recombination:

 

Chem

       1 H3O+  + 1 NO2-           -> 1 H2O   + 1 OH    + 1 NO            /

 1.890e-06                                                               /

Chem

       1 H3O+  + 1 O3-            -> 1 H2O   + 1 OH    + 1 O2            /

 1.000e-06                                                               /

 

 

c     Electron temperature:

 

Etemp

       1 H2O   + 1 O2    + 1 e    -> 1 O2-   + 1 H2O                     /

 1.400e-29                                                               /

 

c ------------------------------------------------------------------------

 

c     Atomic & Molecular Reactions:  Excited State Chemistry

 

Chem

       1 N2a   + 1 N2a            -> 1 N2    + 1 N2+   + 1 e             /

 1.000e-10                                                               /

Chem

       1 N2a   + 1 O2             -> 1 N2    + 2 O                       /

 2.800e-11                                            / K92 (#115)

Chem

       1 N2a   + 1 N2             -> 1 N2    + 1 N2                      /

 2.000e-13                                            / K92 (#114)

Chem

       1 N2a   + 1 NO             -> 1 N2    + 1 N     + 1 O             /

 3.600e-10                                            / K92 (#116)

 

c                           ---------------

 

Chem

       1 N2A   + 1 N2             -> 1 N2    + 1 N2                      /

 3.000e-18                                            / K92 (#105)

Chem

       1 N2A   + 1 O2             -> 1 N2    + 2 O                       /

 1.290e-12                                            / K92 (#106)

Chem

       1 N2A   + 1 O2             -> 1 N2O   + 1 O                       /

 7.800e-14                                                               /

Chem

       1 N2A   + 1 NO             -> 1 N2    + 1 NO                      /

 7.000e-11                                            / K92 (#109)

Chem

       1 N2A   + 1 O              -> 1 NO    + 1 N                       /

 7.000e-12                                            / DNA72 (#32-22)

Chem

       1 N2A   + 1 O              -> 1 N2    + 1 O1S                     /

 2.100e-11                                            / K92 (#108)

Chem

       1 N2A   + 1 N              -> 1 N2    + 1 N                       /

 5.000e-11                                            / K92 (#107)

Chem

       1 N2A   + 1 N2O            -> 1 N2    + 1 N     + 1 NO            /

 1.000e-11                                                               /

 

c                           ---------------

 

Chem

       1 O1D   + 1 N2             -> 1 O     + 1 N2                      /

 1.800e-11    0.        -107.                         / K92 (#144)

Chem

       1 O1D   + 1 O2             -> 1 O     + 1 O2B1S                   /

 2.560e-11    0.        -67.                          / K92 (#145)

Chem

       1 O1D   + 1 O2             -> 1 O     + 1 O2a1D                   /

 1.000e-12                                                               /

Chem

       1 O1D   + 1 NO             -> 1 O2    + 1 N                       /

 1.700e-10                             / K92 (#149); NIST has 8.5e-11

Chem

       1 O1D   + 1 NO2            -> 1 O2    + 1 NO                      /

 3.000e-10                                            / NIST

Chem

       1 O1D   + 1 N2O            -> 1 NO    + 1 NO                      /

 7.200e-11                             / K92 (#150); NIST has 6.7e-11

Chem

       1 O1D   + 1 N2O            -> 1 N     + 1 NO2                     /

 2.450e-13                        / NIST; 0.005 x rate with N2 + O2 products

Chem

       1 O1D   + 1 N2O            -> 1 N2    + 1 O2                      /

 4.900e-11                             / NIST; K92 (#151) has 4.4e-11

Chem

       1 O1D   + 1 O3             -> 2 O     + 1 O2                      /

 1.200e-10                             / K92 (#147) & NIST; little T dependence

Chem

       1 O1D   + 1 O3             -> 2 O2                                /

 2.400e-10                             / K92 (#148) & NIST; little T dependence

Chem

       1 O1D   + 1 O3             -> 1 O     + 1 O3                      /

 2.400e-10                                            / B82

c Chem

c      1 O1D   + 1 O3             -> 1 O2B1S + 1 O2                      /

c 3.600e-11                                                               /

 

c                           ---------------

 

Chem

       1 O1S   + 1 NO             -> 1 O2    + 1 N                       /

 5.000e-10                                                               /

Chem

       1 O1S   + 1 O2             -> 1 O2    + 1 O                       /

 4.300e-12    0.        850.                          / K92 (#153, 154)

Chem

       1 O1S   + 1 O3             -> 1 O2    + 1 O     + 1 O1D           /

 2.900e-10                                            / K92 (#155)

Chem

       1 O1S   + 1 O3             -> 2 O2                                /

 2.900e-10                                            / K92 (#156)

Chem

       1 O1S   + 1 O2a1D          -> 1 O2    + 1 O1D                     /

 3.600e-11                                            / K92 (#161)

Chem

       1 O1S   + 1 O2a1D          -> 3 O                                 /

 3.400e-11                                            / K92 (#162)

Chem

       1 O1S   + 1 O2a1D          -> 1 O     + 1 O2B1S                   /

 1.300e-10                                            / K92 (#163)

Chem

       1 O1S   + 1 O              -> 1 O     + 1 O1D                     /

 5.000e-11    0.        301.                          / K92 (#164)

 

c                           ---------------

 

Chem

       1 O2a1D + 1 N              -> 1 O     + 1 NO                      /

 2.000e-14    0.        600.                          / K92 (#121)

Chem

       1 O2a1D + 1 O              -> 1 O     + 1 O2                      /

 7.000e-16                                            / K92 (#124)

Chem

       1 O2a1D + 1 NO             -> 1 NO    + 1 O2                      /

 2.500e-11                                            / K92 (#126)

Chem

       1 O2a1D + 1 O3             -> 2 O2    + 1 O                       /

 6.239e-11    0.        2876.     / NIST fit 283-360 K;

c                                   K92 (#119) has 9.7e-13   0.   1564.

Chem

       1 O2a1D + 1 O2             -> 1 O2    + 1 O2                      /

 2.200e-18    0.8                                     / K92 (#123)

Chem

       1 O2a1D + 1 N2             -> 1 O2    + 1 N2                      /

 1.400e-19                                  / A89; K92 (#122) has 3.e-21

Chem

       1 O2a1D + 1 NO             -> 1 O     + 1 NO2                     /

 4.880e-18                                            / NIST

 

c                           ---------------

 

Chem

       1 O2B1S + 1 N2             -> 1 O2a1D + 1 N2                      /

 4.900e-15    0.        253.                          / K92 (#127)

Chem

       1 O2B1S + 1 O2             -> 1 O2a1D + 1 O2                      /

 3.730e-16    2.4       241.      / K92 (#128); A89 has 4.0e-17 @ 298 K

Chem

       1 O2B1S + 1 O3             -> 2 O2a1D + 1 O                       /

 1.800e-11                                            / K92 (#126)

Chem

       1 O2B1S + 1 O              -> 1 O2    + 1 O                       /

 8.000e-14                                            / K92 (#129)

Chem

       1 O2B1S + 1 NO             -> 1 O2a1D + 1 NO                      /

 4.000e-14                                            / K92 (#131)

 

c ------------------------------------------------------------------------

 

c     Ion - Molecule Reactions:

 

c                  Positive Ions

 

Chem

       1 O+    + 1 N2             -> 1 NO+   + 1 N                       /

 3.000e-12                                            / K92 (#187)

 

Chem

       1 O2+   + 1 NO             -> 1 O2    + 1 NO+                     /

 4.400e-10                                            / K92 (#208)

Chem

       1 O2+   + 1 O2    + 1 N2   -> 1 O4+   + 1 N2                      /

 2.400e-30    -3.2                                    / K92 (#167) [O2]

Chem

       1 O2+   + 1 O2    + 1 N    -> 1 O4+   + 1 N                       /

 2.400e-30    -3.2                     / use the rate for M = O2

Chem

       1 O2+   + 1 N              -> 1 NO+   + 1 O                       /

 1.200e-10                                            / K92 (#207)

Chem

       1 O2+   + 1 N2             -> 1 NO+   + 1 NO                      /

 1.000e-17                                            / K92 (#206)

 

Chem

       1 O3+   + 1 O2             -> 1 O2+   + 1 O3                      /

 1.000e-11                                                               /

 

Chem

       1 O4+   + 1 O2a1D          -> 1 O2+   + 1 O2    + 1 O2            /

 1.000e-10                                            / K92 (#228)

Chem

       1 O4+   + 1 O2B1S          -> 1 O2+   + 1 O2    + 1 O2            /

 1.000e-10                                            / K92 (#228)

Chem

       1 O4+   + 1 NO             -> 1 NO+   + 1 O2    + 1 O2            /

 1.000e-10                                            / K92 (#230)

Chem

       1 O4+   + 1 O              -> 1 O3    + 1 O2+                     /

 3.000e-10                                       / K92 (#229); DNA (14-22)

Chem

       1 O4+   + 1 O              -> 1 O3+   + 1 O2                      /

 3.000e-10                                                               /

Chem                                                                     /

       1 O4+   + 1 O              -> 1 O2+   + 1 O3                      /

 3.000e-10                                                               /

Chem                                                                     /

       1 O4+   + 1 O2             -> 1 O2+   + 1 O2    + 1 O2            /

 2.000e-13                                                               /

 

c                           ---------------

 

Chem

       1 N2+   + 1 O              -> 1 N2    + 1 O+                      /

 1.000e-11    -0.2                                    / K92 (#199)

Chem

       1 N2+   + 1 O              -> 1 NO+   + 1 N                       /

 1.300e-10    -0.5                                    / K92 (#198)

Chem

       1 N2+   + 1 O2             -> 1 N2    + 1 O2+                     /

 6.000e-11    -0.5                                    / K92 (#197)

Chem

       1 N2+   + 1 NO             -> 1 N2    + 1 NO+                     /

 3.300e-10                                            / K92 (#203)

Chem

       1 N2+   + 1 N2    + 1 N2   -> 1 N4+   + 1 N2                      /

 5.000e-29    -1.            / DNA72 (#19-6); also K92 (#165) w/o T dependence

Chem

       1 N2+   + 1 N2    + 1 N    -> 1 N4+   + 1 N                       /

 5.000e-29    -1.                      / use the rate for M = N2

Chem                                                                     /

       1 N4+   + 1 O2             -> 1 O2+   + 1 N2    + 1 N2            /

 2.500e-10                                                               /

Chem                                                                     /

       1 N4+   + 1 O              -> 1 O+    + 1 N2    + 1 N2            /

 2.500e-10                                                               /

 

 

c                  Negative Ions

 

Chem

       1 O-    + 1 N2             -> 1 N2O   + 1 e                       /

 1.000e-12                                                               /

Chem

       1 O-    + 1 O2             -> 1 O3    + 1 e                       /

 5.000e-15                                            / K92 (#72)

Chem

       1 O-    + 1 O              -> 1 O2    + 1 e                       /

 5.000e-10                                            / K92 (#68)

Chem

       1 O-    + 1 N              -> 1 NO    + 1 e                       /

 2.600e-10                                            / K92 (#69)

Chem

       1 O-    + 1 N2A            -> 1 O     + 1 N2    + 1 e             /

 2.200e-9                                             / K92 (#64)

Chem

       1 O-    + 1 O2a1D          -> 1 O3    + 1 e                       /

 3.000e-10                                            / K92 (#62)

Chem

       1 O-    + 1 O3             -> 2 O2    + 1 e                       /

 5.300e-10                                            / K92 (#243)

Chem

       1 O-    + 1 NO             -> 1 NO2   + 1 e                       /

 2.600e-10                                            / K92 (#73)

Chem

       1 O-    + 1 N2O            -> 1 NO-   + 1 NO                      /

 2.100e-10                                            / K92 (#245)

Chem

       1 O-    + 1 NO2            -> 1 O     + 1 NO2-                    /

 1.200e-09                                            / K92 (#244)

Chem

       1 O-    + 1 NO2            -> 1 O2-   + 1 NO                      /

 2.000e-11                                                               /

Chem

       1 O-    + 1 O2    + 1 O2   -> 1 O3-   + 1 O2                      /

 1.100e-30                                            / K92 (#235)

Chem

       1 O-    + 1 O3             -> 1 O3-   + 1 O                       /

 5.500e-10                             / SGG87; K92 (#243) has 5.3e-10

Chem

       1 O-    + 1 O3             -> 1 O2-   + 1 O2                      /

 1.000e-11                                            / SGG87

 

c                           ---------------

 

Chem

       1 O2-   + 1 O              -> 1 O-    + 1 O2                      /

 3.310e-10                                            / K92 (#237)

Chem

       1 O2-   + 1 O              -> 1 O3    + 1 e                       /

 1.500e-10                                            / K92 (#66)

Chem

       1 O2-   + 1 O2             -> 1 O2    + 1 O2    + 1 e             /

 2.700e-18    0.5       5590.                         / K92 (#57)

Chem

       1 O2-   + 1 O2a1D          -> 1 O2    + 1 O2    + 1 e             /

 2.000e-10                                            / K92 (#58)

Chem

       1 O2-   + 1 O2B1S          -> 1 O2    + 1 O2    + 1 e             /

 3.600e-10                                            / K92 (#59)

Chem

       1 O2-   + 1 N2             -> 1 O2    + 1 N2    + 1 e             /

 1.100e-19                                                               /

Chem

       1 O2-   + 1 NO2            -> 1 NO2-  + 1 O2                      /

 8.000e-10                                            / K92 (#239)

Chem

       1 O2-   + 1 N              -> 1 NO2   + 1 e                       /

 5.000e-10                                       / K92 (#67); DNA72 (#12-11)

Chem

       1 O2-   + 1 O3             -> 1 O2    + 1 O3-                     /

 4.000e-10                                       / K92 (#239); DNA72 (#15-5)

 

c                           ---------------

 

Chem

       1 O3-   + 1 O              -> 1 O2-   + 1 O2                      /

 1.100e-11                                            / SGG87

Chem

       1 O3-   + 1 O              -> 2 O2    + 1 e                       /

 1.400e-10                                            / K92 (#70)

Chem

       1 O3-   + 1 N2             -> 1 NO2-  + 1 NO                      /

 1.000e-20                                            / SGG87

Chem

       1 O3-   + 1 NO             -> 1 NO3-  + 1 O                       /

 1.000e-11                                            / K92 (#248)

Chem

       1 O3-   + 1 NO2            -> 1 O3    + 1 NO2-                    /

 7.000e-10                                       / K92 (#250)

Chem

       1 O3-   + 1 NO2            -> 1 NO3-  + 1 O2                      /

 2.000e-11                                            / K92 (#251)

 

c                           ---------------

 

Chem

       1 NO-   + 1 O2             -> 1 O2-   + 1 NO                      /

 5.000e-10                                            / K92 (#253)

Chem

       1 NO-   + 1 NO2            -> 1 NO2-  + 1 NO                      /

 7.400e-16                                            / K92 (#254)

Chem

       1 NO-   + 1 N2O            -> 1 NO2-  + 1 N2                      /

 2.800e-14                                            / K92 (#255)

 

Chem

       1 NO2-  + 1 O3             -> 1 O2    + 1 NO3-                    /

 9.000e-11                             / SGG87; K92 (#256) has 1.8e-11

 

 

c ------------------------------------------------------------------------

 

c     Negative Ion Clusters:

 

Chem

       1 O-    + 1 H2O   + 1 N2   -> 1 H2O2- + 1 N2                      /

 1.300e-28                                                               /

Chem

       1 O-    + 1 H2O   + 1 O2   -> 1 H2O2- + 1 O2                      /

 1.300e-28                                                               /

Chem

       1 O2-   + 1 H2O   + 1 N2   -> 1 H2O3- + 1 N2                      /

 2.200e-28                                                               /

Chem                                                                     /

       1 O2-   + 1 H2O   + 1 O2   -> 1 H2O3- + 1 O2                      /

 2.200e-28                                                               /

Chem                                                                     /

       1 O3-   + 1 H2O   + 1 N2   -> 1 H2O4- + 1 N2                      /

 2.700e-28                                                               /

Chem                                                                     /

       1 O3-   + 1 H2O   + 1 O2   -> 1 H2O4- + 1 O2                      /

 2.700e-28                                                               /

Chem                                                                     /

       1 OH-   + 1 H2O   + 1 N2   -> 1 H3O2- + 1 N2                      /

 2.500e-28                                                               /

Chem                                                                     /

       1 OH-   + 1 H2O   + 1 O2   -> 1 H3O2- + 1 O2                      /

 2.500e-28                                                               /

Chem                                                                     /

       1 NO-   + 1 H2O   + 1 N2   -> 1 NO-w  + 1 N2                      /

 1.000e-28                                                               /

Chem                                                                     /

       1 NO-   + 1 H2O   + 1 O2   -> 1 NO-w  + 1 O2                      /

 1.000e-28                                                               /

Chem                                                                     /

       1 NO2-  + 1 H2O   + 1 N2   -> 1 NO2-w + 1 N2                      /

 1.600e-28                                                               /

Chem                                                                     /

       1 NO2-  + 1 H2O   + 1 O2   -> 1 NO2-w + 1 O2                      /

 1.600e-28                                                               /

 

c ------------------------------------------------------------------------

 

c     Ionic Recombination of + & - Clusters:

Chem                                                                     /

       1 H3O+  + 1 H2O2-          -> 2 H2O   + 1 OH                      /

 1.000e-06                                                               /

Chem                                                                     /

       1 H3O+  + 1 H2O3-          -> 2 H2O   + 1 HO2                     /

 1.000e-06                                                               /

Chem                                                                     /

       1 H3O+  + 1 H2O4-          -> 2 H2O   + 1 OH    + 1 O2            /

 1.000e-06                                                               /

Chem                                                                     /

       1 H3O+  + 1 H3O2-          -> 3 H2O                               /

 1.000e-06                                                               /

Chem                                                                     /

       1 H3O+  + 1 NO-w           -> 2 H2O   + 1 HNO                     /

 1.000e-06                                                               /

Chem                                                                     /

       1 H3O+  + 1 NO2-w          -> 2 H2O   + 1 HNO2                    /

 1.000e-06                                                               /

c                                                                        /

Chem                                                                     /

       1 OH+   + 1 H2O2-          -> 1 H2O   + 1 HO2                     /

 1.000e-06                                                               /

Chem                                                                     /

       1 OH+   + 1 H2O3-          -> 1 H2O   + 1 OH    + 1 O2            /

 1.000e-06                                                               /

Chem                                                                     /

       1 OH+   + 1 H2O4-          -> 1 H2O   + 1 HO2   + 1 O2            /

 1.000e-06                                                               /

Chem                                                                     /

       1 OH+   + 1 H3O2-          -> 2 H2O   + 1 O                       /

 1.000e-06                                                               /

Chem                                                                     /

       1 OH+   + 1 NO-w           -> 1 H2O   + 1 HNO2                    /

 1.000e-06                                                               /

Chem                                                                     /

       1 OH+   + 1 NO2-w          -> 1 H2O   + 1 HNO3                    /

 1.000e-06                                                               /

c                                                                        /

Chem                                                                     /

       1 O2+   + 1 H2O2-          -> 1 H2O   + 1 O3                      /

 1.000e-06                                                               /

Chem                                                                     /

       1 O2+   + 1 H2O3-          -> 1 H2O   + 2 O2                      /

 1.000e-06                                                               /

Chem                                                                     /

       1 O2+   + 1 H2O4-          -> 1 H2O   + 1 O3    + 1 O2            /

 1.000e-06                                                               /

Chem                                                                     /

       1 O2+   + 1 H3O2-          -> 1 H2O2  + 1 HO2                     /

 1.000e-06                                                               /

Chem                                                                     /

       1 O2+   + 1 NO-w           -> 1 H2O   + 1 NO3                     /

 1.000e-06                                                               /

Chem                                                                     /

       1 O2+   + 1 NO2-w          -> 1 H2O   + 1 NO2   + 1 O2            /

 1.000e-06                                                               /

c                                                                        /

Chem                                                                     /

       1 NO+   + 1 H2O2-          -> 1 H2O   + 1 NO2                     /

 1.000e-06                                                               /

Chem                                                                     /

       1 NO+   + 1 H2O3-          -> 1 H2O   + 1 NO3                     /

 1.000e-06                                                               /

Chem                                                                     /

       1 NO+   + 1 H2O4-          -> 1 H2O   + 1 NO2   + 1 O2            /

 1.000e-06                                                               /

Chem                                                                     /

       1 NO+   + 1 H3O2-          -> 1 H2O   + 1 HNO2                    /

 1.000e-06                                                               /

Chem                                                                     /

       1 NO+   + 1 NO-w           -> 1 H2O   + 2 NO                      /

 1.000e-06                                                               /

Chem                                                                     /

       1 NO+   + 1 NO2-w          -> 1 H2O   + 1 NO2   + 1 NO            /

 1.000e-06                                                               /

 

Chem

       1 O2-   + 1 NO+            -> 1 O2    + 1 N     + 1 O             /

 1.000e-07                                                               /

Chem

       1 O3-   + 1 O+             -> 1 O3    + 1 O                       /

 2.000e-07                                                               /

Chem

       1 O3-   + 1 O2+            -> 1 O3    + 1 O2                      /

 2.000e-07                                                               /

Chem

       1 O3-   + 1 O2+            -> 2 O     + 1 O3                      /

 1.000e-07                                                               /

Chem

       1 O3-   + 1 NO+            -> 1 O3    + 1 NO                      /

 2.000e-07                                                               /

Chem

       1 NO3-  + 1 NO+            -> 1 NO3   + 1 N     + 1 O             /

 1.000e-07                                                               /

Chem

       1 NO3-  + 1 O2+            -> 1 NO3   + 1 O     + 1 O             /

 1.000e-07                                                               /

Chem

       1 O-    + 1 O2+            -> 1 O     + 1 O2                      /

 2.000e-07                                                               /

Chem

       1 O-    + 1 O2+   + 1 O2   -> 1 O3    + 1 O2                      /

 2.000e-25                                                               /

Chem

       1 O-    + 1 NO+   + 1 O2   -> 1 NO2   + 1 O2                      /

 2.000e-25                                                               /

Chem

       1 O2-   + 1 O2+            -> 1 O2    + 1 O2                      /

 4.200e-07                                                               /

Chem

       1 O2-   + 1 NO+   + 1 O2   -> 2 O2    + 1 NO                      /

 2.000e-25                                                               /

 

 

c   **********************************************************************

 

 

c Electron Collisions:

 

Boltz

       1 N2     + 1 e        -> 1 N2v    + 1 e         /

      N2      N2v1

 

c --------------------------------------------------------------

 

c     the V-T rates are V-scaled based on the P(1,0) transition

c     probability shown by Center & Caledonia (1971)

 

Chem

       1 N2v    + 1 Ar       -> 1 N2     + 1 Ar        /  V-T

      4.e-20       0.5 /

 

 

c --------------------------------------------------------------

 

c     the following all use the same V-V rate coefficient based on

c     the canonical P(1,0;0,1) V-V transition probability of 10^-3

c     from Center & Caledonia (1971)

 

c Chem

c      2 N2v1                -> 1 N2v2   + 1 N2        /  V-V

c     8.e-11       0.5 /

 

 

c --------------------------------------------------------------

 

c     CO2 chemistry

 

Boltz

       1 CO2    + 1 e        -> 1 CO2v   + 1 e         /

      CO2     CO2v

 

Boltz

       1 CO2    + 1 e        -> 1 CO     + 1 O-        /

      CO2     CO+O-

 

Chem

       1 O-   + 1 CO2  + 1 Ar  -> 1 CO3-  + 1 Ar       / negative ion formation

      1.5e-28       /   Smirnov (M = He)

 

Chem

       1 O-   + 2 CO2          -> 1 CO3-  + 1 CO2      / negative ion formation

      1.e-27        /   Smirnov

 

 

c --------------------------------------------------------------

 

 

c     CO2 chemistry

 

Chem

       1 CO2  + 1 O            -> 1 CO    + 1 O2       /

      4.285e-11    0.        26710.    / NIST, 300-6000 K fit

 

Chem

       1 CO2  + 1 H            -> 1 CO    + 1 OH       /

      4.043e-10    0.        13280.    / NIST, 300-3000 K fit

 

c Chem

c      1 CO2  + 1 O1D          -> 1 CO    + 1 O2       /

c     2.e-10                           / NIST

 

Chem

       1 CO2  + 1 O1D          -> 1 CO2   + 1 O        /

      7.4e-11      0.        -120.     / NIST, 200-300 K

 

Chem

       1 CO2  + 1 O1S          -> 1 CO2   + 1 O        /

      3.1e-11      0.        -1320.    / McGKG, 200-450 K

 

 

c     CO chemistry

 

Chem

       1 CO   + 1 O    + 1 N2  -> 1 CO2   + 1 N2       /

      1.182e-33    0.        1470.     / NIST, 250-4000 K fit

 

Chem

       1 CO   + 1 O2           -> 1 CO2   + 1 O        /

      6.57e-12     0.        23940.    / NIST, 300-6000 K fit

 

Chem

       1 CO   + 1 O1D          -> 1 CO2                /

      7.3e-11                          / NIST (73HEI/HUS)

 

Chem

       1 CO   + 1 N            -> 1 CN    + 1 O        /

      3.83e-9      0.        35990.    / NIST (86IBR), 4000-8000 K

 

Chem

       1 CO   + 1 NO2          -> 1 CO2   + 1 NO       /

      1.374e-10    0.        16980.    / NIST, 298-2000 K fit

 

Chem

       1 CO   + 1 N2O          -> 1 CO2   + 1 N2       /

      1.38e-10     0.        20550.    / NIST, 1060-2500 K fit

 

Chem

       1 CO   + 1 H    + 1 N2  -> 1 HCO   + 1 N2       /

      1.9e-33      0.        842.      / NIST (84WAR), 300-2500 K

 

Chem

       1 CO   + 1 OH           -> 1 CO2   + 1 H        /

      2.175e-14    1.812     -593.9    / NIST, 200-2600 K fit

 

Chem

       1 CO   + 1 HO2          -> 1 CO2   + 1 OH       /

      4.744e-10    0.        12230.    / NIST, 300-2500 K fit

 

 

c     Negative Ion chemistry

 

Chem

       1 O-   + 1 CO           -> 1 CO2   + 1 e        /

      6.e-10       -0.32               / DNA (12-9); Smirnov

 

Chem

       1 H2O3- + 1 CO2          -> 1 CO4-  + 1 H2O      /

      5.8e-10                          / DNA (16-21)

 

Chem

       1 CO3- + 1 O            -> 1 O2-   + 1 CO2      /

      8.e-11                           / DNA (16-22)

 

Chem

       1 CO3- + 1 NO           -> 1 NO2-  + 1 CO2      /

      9.e-12                           / DNA (16-23)

 

Chem

       1 CO3- + 1 NO2          -> 1 NO3-  + 1 CO2      /

      8.e-11                           / DNA (16-24)

 

Chem

       1 CO4- + 1 O            -> 1 CO3-  + 1 O2       /

      1.5e-10                          / DNA (16-25)

 

Chem

       1 CO4- + 1 O2           -> 1 O4-   + 1 CO2      /

      4.3e-10      0.        3000.     / DNA (16-26)

 

Chem

       1 CO4- + 1 NO           -> 1 NO3-  + 1 CO2      /

      4.8e-11                          / DNA (16-27)

 

 

 

End_List /