CHEMKIN INTERPRETER OUTPUT: CHEMKIN-II Version 3.6 Apr. 1994 DOUBLE PRECISION -------------------- ELEMENTS ATOMIC CONSIDERED WEIGHT -------------------- 1. H 1.00797 2. O 15.9994 3. N 14.0067 4. AR 39.9480 5. C 12.0112 -------------------- ------------------------------------------------------------------------------- C P H H A A R SPECIES S G MOLECULAR TEMPERATURE ELEMENT COUNT CONSIDERED E E WEIGHT LOW HIGH H O N AR C ------------------------------------------------------------------------------- 1. H2 G 0 2.01594 300.0 5000.0 2 0 0 0 0 2. H G 0 1.00797 300.0 5000.0 1 0 0 0 0 3. O2 G 0 31.99880 300.0 5000.0 0 2 0 0 0 4. O G 0 15.99940 300.0 5000.0 0 1 0 0 0 5. OH G 0 17.00737 300.0 5000.0 1 1 0 0 0 6. HO2 G 0 33.00677 300.0 5000.0 1 2 0 0 0 7. H2O2 G 0 34.01474 300.0 5000.0 2 2 0 0 0 8. H2O G 0 18.01534 300.0 5000.0 2 1 0 0 0 9. N G 0 14.00670 300.0 5000.0 0 0 1 0 0 10. N2 G 0 28.01340 300.0 5000.0 0 0 2 0 0 11. NO G 0 30.00610 300.0 5000.0 0 1 1 0 0 12. NH G 0 15.01467 300.0 5000.0 1 0 1 0 0 13. NH2 G 0 16.02264 300.0 5000.0 2 0 1 0 0 14. NH3 G 0 17.03061 300.0 5000.0 3 0 1 0 0 15. HNO G 0 31.01407 300.0 5000.0 1 1 1 0 0 16. NO2 G 0 46.00550 300.0 5000.0 0 2 1 0 0 17. NNH G 0 29.02137 250.0 4000.0 1 0 2 0 0 18. N2H2 G 0 30.02934 300.0 5000.0 2 0 2 0 0 19. N2O G 0 44.01280 300.0 5000.0 0 1 2 0 0 20. HNO2 G 0 47.01347 300.0 4000.0 1 2 1 0 0 21. NO3 G 0 62.00490 300.0 5000.0 0 3 1 0 0 22. AR G 0 39.94800 300.0 5000.0 0 0 0 1 0 ------------------------------------------------------------------------------- (k = A T**b exp(-E/RT)) REACTIONS CONSIDERED A b E 1. H+O2=OH+O 2.00E+14 0.0 70300.0 2. O+H2=OH+H 5.12E+04 2.7 26300.0 3. OH+H2=H2O+H 1.00E+08 1.6 13800.0 4. 2OH=H2O+O 1.50E+09 1.1 420.0 5. O2+H+M=HO2+M 2.30E+15 -0.8 0.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 6. HO2+H=2OH 1.68E+14 0.0 3660.0 7. HO2+H=H2+O2 4.27E+13 0.0 5900.0 8. HO2+OH=H2O+O2 2.89E+13 0.0 -2080.0 9. HO2+H=H2O+O 3.00E+13 0.0 7200.0 10. HO2+O=OH+O2 3.19E+13 0.0 0.0 11. 2HO2=H2O2+O2 1.86E+12 0.0 6440.0 12. H2O2+H=H2O+OH 1.00E+13 0.0 15000.0 13. H2O2+H=HO2+H2 1.70E+12 0.0 15700.0 14. H2O2+O=HO2+OH 6.60E+11 0.0 16600.0 15. H2O2+OH=H2O+HO2 7.83E+12 0.0 5570.0 16. H2O2+M=2OH+M 1.20E+17 0.0 190000.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 17. 2H+M=H2+M 6.50E+14 -1.0 0.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 18. H+OH+M=H2O+M 2.20E+19 -2.0 0.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 19. 2O+M=O2+M 1.88E+10 0.0 7480.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 20. NH3+M=NH2+H+M 1.40E+16 0.1 379070.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 21. NH3+H=NH2+H2 6.36E+05 2.4 42555.0 22. NH3+OH=NH2+H2O 2.04E+06 2.0 2368.0 23. NH3+O=NH2+OH 2.10E+13 0.0 37656.0 24. NH2+H=NH+H2 5.67E+11 0.6 15262.0 25. NH2+OH=NH+H2O 9.00E+07 1.5 -1912.0 26. NH2+O=NH+OH 7.00E+12 0.0 0.0 27. NH2+O=HNO+H 9.90E+14 -0.5 0.0 28. NH2+N=N2+2H 7.20E+13 0.0 0.0 29. NH2+NO=N2+H2O 3.00E+20 -2.6 3866.0 30. NH+H=N+H2 1.00E+13 0.0 0.0 31. NH+O=NO+H 7.00E+13 0.0 0.0 32. NH+OH=N+H2O 2.00E+09 1.2 25.0 33. NH+OH=HNO+H 4.00E+13 0.0 0.0 34. NH+O2=NO+OH 1.00E+13 -0.2 20080.0 35. NH+N=N2+H 3.00E+13 0.0 0.0 36. NH+NO=N2O+H 2.94E+14 -0.4 0.0 Declared duplicate reaction... 37. NH+NO=N2O+H ******** -0.2 0.0 Declared duplicate reaction... 38. 2NH=N2+2H 2.54E+13 0.0 0.0 39. N+O2=NO+O 6.40E+09 1.0 26275.0 40. N+OH=NO+H 3.80E+13 0.0 0.0 41. N+NO=N2+O 3.30E+12 0.3 0.0 42. NO+HO2=NO2+OH 2.11E+12 0.0 -2004.0 43. NO2(+M)=NO+O(+M) 7.60E+21 -1.3 306645.0 Low pressure limit: 0.21600E+26 -0.26600E+01 0.31088E+06 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 44. NO2+H=NO+OH 3.50E+14 0.0 6276.0 45. NO2+O=NO+O2 3.90E+12 0.0 -997.0 46. 2NO2=2NO+O2 1.62E+12 0.0 109304.0 47. N2H2+M=NNH+H+M 1.17E+17 0.0 209200.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 48. N2H2+H=NNH+H2 5.00E+13 0.0 4184.0 49. N2H2+O=NH2+NO 1.00E+13 0.0 0.0 50. N2H2+O=NNH+OH 2.00E+13 0.0 4184.0 51. N2H2+OH=NNH+H2O 1.00E+11 0.0 4184.0 52. N2H2+NO=NH2+N2O 3.00E+12 0.0 0.0 53. N2H2+NH=NNH+NH2 1.00E+13 0.0 4184.0 54. N2H2+NH2=NNH+NH3 1.00E+13 0.0 4184.0 55. NNH+M=N2+H+M 1.70E+12 0.0 59860.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 56. NNH+OH=N2+H2O 5.00E+13 0.0 0.0 57. NNH+NH2=N2+NH3 5.00E+13 0.0 0.0 58. NO+NNH=N2+HNO 2.00E+12 0.0 0.0 59. NH2+NH=N2H2+H 1.00E+15 -0.5 0.0 60. 2NH2=N2H2+H2 4.00E+13 0.0 49551.0 61. NH2+NO=NNH+OH 1.39E+12 0.0 0.0 62. N2O+H=N2+OH 2.53E+10 0.0 19037.0 Declared duplicate reaction... 63. N2O+H=N2+OH 2.23E+14 0.0 70081.0 Declared duplicate reaction... 64. N2O+O=2NO 5.60E+14 0.0 117148.0 65. N2O+O=N2+O2 7.00E+14 0.0 117148.0 66. N2O+M=N2+O+M 5.00E+13 0.0 252995.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 67. N2O+OH=N2+HO2 2.00E+12 0.0 41840.0 68. HNO+M=H+NO+M 2.35E+16 0.0 203677.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 69. HNO+H=H2+NO 5.00E+12 0.0 0.0 70. HNO+OH=H2O+NO 7.20E+13 0.0 0.0 71. HNO+O=OH+NO 3.60E+13 0.0 0.0 72. 2HNO=H2O+N2O 3.90E+12 0.0 209200.0 73. HNO+NH2=NH3+NO 2.00E+13 0.0 4184.0 74. HNO+NO=N2O+OH 2.00E+12 0.0 108784.0 75. NH2+O2=HNO+OH 1.51E+12 -3.9 151040.0 76. NH+O2=HNO+O 4.61E+05 2.0 27196.0 77. HNO+NO2=HNO2+NO 6.02E+11 0.0 8314.0 78. HNO2(+M)=OH+NO(+M) 1.20E+22 -1.2 207933.0 Low pressure limit: 0.10230E+31 -0.35900E+01 0.20993E+06 SRI centering: 0.62000E+00 0.00000E+00 0.00000E+00 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 79. HNO2+H=H2+NO2 1.20E+13 0.0 24942.0 80. HNO2+OH=H2O+NO2 1.26E+10 1.0 565.0 81. HNO2+O=OH+NO2 1.20E+13 0.0 30762.0 82. NO2+O+M=NO3+M 1.32E+13 0.0 0.0 H2O Enhanced by 6.500E+00 N2 Enhanced by 4.000E-01 AR Enhanced by 4.000E-01 83. NO3+O=NO2+O2 6.03E+12 0.0 0.0 84. NO3+OH=NO2+HO2 1.39E+13 0.0 0.0 85. NO3+H=NO2+OH 6.62E+13 0.0 0.0 86. NO3+NO=2NO2 9.64E+12 0.0 -1247.0 87. HNO+O2=NO+HO2 3.16E+12 0.0 12552.0 88. NH2+O2=NH+HO2 1.00E+14 0.0 209188.0 89. NH2+HO2=NH3+O2 4.52E+13 0.0 0.0 90. NNH+NH=N2+NH2 5.00E+13 0.0 0.0 91. NH+NO=N2+OH 2.16E+13 -0.2 0.0 92. NNH+O=NO+NH 1.00E+13 0.0 0.0 93. NNH+O=N2+OH 1.00E+13 0.0 20920.0 94. 2NH2=NH+NH3 5.00E+13 0.0 41570.0 95. NH2+NO=N2O+H2 5.00E+13 0.0 102428.0 96. NH+O=N+OH 7.00E+12 0.0 0.0 97. NH2+O=NO+H2 5.00E+12 0.0 0.0 NOTE: E units Joules/mol, A units mole-cm-sec-K NO ERRORS FOUND ON INPUT...CHEMKIN LINKING FILE WRITTEN. WORKING SPACE REQUIREMENTS ARE INTEGER: 1697 REAL: 1608 CHARACTER: 27