CHEMKIN INTERPRETER OUTPUT: CHEMKIN-II Version 3.6 Apr. 1994 DOUBLE PRECISION -------------------- ELEMENTS ATOMIC CONSIDERED WEIGHT -------------------- 1. H 1.00797 2. C 12.0112 3. O 15.9994 4. N 14.0067 5. AR 39.9480 -------------------- ------------------------------------------------------------------------------- C P H H A A R SPECIES S G MOLECULAR TEMPERATURE ELEMENT COUNT CONSIDERED E E WEIGHT LOW HIGH H C O N AR ------------------------------------------------------------------------------- 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 0 2 0 0 4. O G 0 15.99940 300.0 5000.0 0 0 1 0 0 5. OH G 0 17.00737 300.0 5000.0 1 0 1 0 0 6. HO2 G 0 33.00677 300.0 5000.0 1 0 2 0 0 7. H2O2 G 0 34.01474 300.0 5000.0 2 0 2 0 0 8. H2O G 0 18.01534 300.0 5000.0 2 0 1 0 0 9. N G 0 14.00670 300.0 5000.0 0 0 0 1 0 10. N2 G 0 28.01340 300.0 5000.0 0 0 0 2 0 11. NO G 0 30.00610 300.0 5000.0 0 0 1 1 0 12. AR G 0 39.94800 300.0 5000.0 0 0 0 0 1 13. NH G 0 15.01467 300.0 5000.0 1 0 0 1 0 14. HNO G 0 31.01407 300.0 5000.0 1 0 1 1 0 15. NO2 G 0 46.00550 300.0 5000.0 0 0 2 1 0 16. N2O G 0 44.01280 300.0 5000.0 0 0 1 2 0 17. NH3 G 0 17.03061 300.0 5000.0 3 0 0 1 0 18. NH2 G 0 16.02264 300.0 5000.0 2 0 0 1 0 19. CH G 0 13.01912 300.0 5000.0 1 1 0 0 0 20. CO G 0 28.01055 300.0 5000.0 0 1 1 0 0 21. CH2 G 0 14.02709 250.0 4000.0 2 1 0 0 0 22. CH2(S) G 0 14.02709 300.0 4000.0 2 1 0 0 0 23. CH4 G 0 16.04303 300.0 5000.0 4 1 0 0 0 24. CH3 G 0 15.03506 300.0 5000.0 3 1 0 0 0 25. CH2O G 0 30.02649 300.0 5000.0 2 1 1 0 0 26. HCO G 0 29.01852 300.0 5000.0 1 1 1 0 0 27. CH3O G 0 31.03446 300.0 3000.0 3 1 1 0 0 28. NCO G 0 42.01725 300.0 4000.0 0 1 1 1 0 29. HCN G 0 27.02582 300.0 4000.0 1 1 0 1 0 30. C2H G 0 25.03027 300.0 4000.0 1 2 0 0 0 31. C2H2 G 0 26.03824 300.0 5000.0 2 2 0 0 0 32. HCCO G 0 41.02967 300.0 4000.0 1 2 1 0 0 33. HNCO G 0 43.02522 300.0 4000.0 1 1 1 1 0 34. C2O G 0 40.02170 300.0 5000.0 0 2 1 0 0 35. CH2CO G 0 42.03764 300.0 5000.0 2 2 1 0 0 36. CN G 0 26.01785 300.0 5000.0 0 1 0 1 0 37. CH2OH G 0 31.03446 250.0 4000.0 3 1 1 0 0 38. C G 0 12.01115 300.0 5000.0 0 1 0 0 0 39. NNH G 0 29.02137 250.0 4000.0 1 0 0 2 0 40. HOCN G 0 43.02522 300.0 4000.0 1 1 1 1 0 41. CO2 G 0 44.00995 300.0 5000.0 0 1 2 0 0 42. CH3OH G 0 32.04243 300.0 5000.0 4 1 1 0 0 ------------------------------------------------------------------------------- (k = A T**b exp(-E/RT)) REACTIONS CONSIDERED A b E 1. O+H2=OH+H 8.50E-20 2.7 3160.0 2. O+OH=>O2+H 2.40E-11 0.0 353.0 3. O+HO2=OH+O2 5.30E-11 0.0 0.0 4. O+H2O2=OH+HO2 1.10E-12 0.0 2000.0 5. O+NO=>O2+N 1.14E-15 1.1 19200.0 6. O+N2=>N+NO 3.00E-10 0.0 38300.0 7. O+NH=NO+H 7.50E-11 0.0 0.0 8. O+NH=N+OH 7.50E-11 0.0 0.0 9. O+NH3=>OH+NH2 1.60E-11 0.0 3670.0 10. O+CH=CO+H 6.60E-11 0.0 0.0 11. O+CH2=CO+2H 1.20E-10 0.0 0.0 12. O+CH2=CO+H2 8.00E-11 0.0 0.0 13. O+CH3=CH2O+H 1.40E-10 0.0 0.0 14. O+CH4=OH+CH3 1.20E-15 1.6 4270.0 15. O+HCO=OH+CO 5.00E-11 0.0 0.0 16. O+HCO=CO2+H 5.00E-11 0.0 0.0 17. O+CH2O=OH+HCO 6.90E-13 0.6 1390.0 18. O+CH3O=>O2+CH3 2.20E-11 0.0 0.0 19. O+CH3O=OH+CH2O 3.00E-12 0.0 0.0 20. O+CN=>CO+N 1.70E-11 0.0 0.0 21. O+NCO=NO+CO 3.50E-11 0.0 0.0 22. O+NCO=>O2+CN 3.50E-11 0.0 0.0 23. O+HCN=>NCO+H 7.67E-19 2.1 3075.0 24. O+HCN=CO+NH 7.67E-19 2.1 3075.0 25. O+HCN=>OH+CN 7.67E-19 2.1 3075.0 26. O+C2H=CO+CH 3.60E-12 0.0 0.0 27. O+C2H2=CO+CH2 8.40E-18 2.1 790.0 28. O+C2H2=HCCO+H 1.20E-17 2.1 790.0 29. O+HCCO=2CO+H 1.60E-10 0.0 0.0 30. O2+CH4=HO2+CH3 6.60E-11 0.0 28630.0 31. O2+CH2O=HO2+HCO 1.00E-10 0.0 20460.0 32. H+O2=>OH+O 1.62E-10 0.0 7470.0 33. H+O2+M=HO2+M 1.70E-30 -0.8 0.0 H2 Enhanced by 3.410E+00 N2 Enhanced by 2.290E+00 34. H+H+M=>H2+M 1.80E-30 -1.0 0.0 H2 Enhanced by 0.000E+00 35. H+H+H2=>H2+H2 2.70E-31 -0.6 0.0 36. H+OH+M=>H2O+M 2.30E-26 -2.0 0.0 H2O Enhanced by 1.696E+01 N2 Enhanced by 2.650E+00 37. H+HO2=H2+O2 7.10E-11 0.0 710.0 38. H+HO2=2OH 2.80E-10 0.0 440.0 39. H+HO2=H2O+O 5.00E-11 0.0 866.0 40. H+H2O=>OH+H2 7.50E-16 1.6 9270.0 41. H+H2O2=H2+HO2 2.80E-12 0.0 1890.0 42. H+H2O2=OH+H2O 1.70E-11 0.0 1800.0 43. H+NO=>OH+N 3.60E-10 0.0 24910.0 44. H+NH=H2+N 1.70E-11 0.0 0.0 45. H+NH2=H2+NH 1.00E-11 0.0 0.0 46. H+CO+M=>HCO+M 5.30E-34 0.0 370.0 47. H+CH2=>H2+CH 1.00E-11 0.0 -900.0 48. H+CH3=>H2+CH2(S) 1.00E-10 0.0 7600.0 49. H+CH3(+M)=>CH4(+M) 3.50E-10 0.0 0.0 Low pressure limit: 0.17000E-23 -0.18000E+01 0.00000E+00 TROE centering: 0.37000E+00 0.33150E+04 0.61000E+02 50. H+CH4=>H2+CH3 2.20E-20 3.0 4045.0 51. H+HCO=H2+CO 1.50E-10 0.0 0.0 52. H+CH2O=H2+HCO 2.10E-16 1.6 1090.0 53. H+CH3O=H2+CH2O 3.00E-11 0.0 0.0 54. H+HNCO=H2+NCO 3.40E-10 -0.3 10190.0 55. H+NCO=NH+CO 4.35E-11 0.0 0.0 56. H+NCO=>HCN+O 4.35E-11 0.0 0.0 57. H+C2H2=>H2+C2H 1.10E-10 0.0 14000.0 58. H+HCCO=CH2+CO 8.33E-11 0.0 0.0 59. H+HCCO=H2+C2O 8.33E-11 0.0 0.0 60. H+CH2CO=CH3+CO 3.00E-11 0.0 1700.0 61. H2+M=>2H+M 3.70E-10 0.0 48350.0 H2 Enhanced by 4.050E+00 62. OH+H2=>H2O+H 1.70E-16 1.6 1660.0 63. 2OH=H2O+O 2.50E-15 1.1 50.0 64. OH+OH(+M)=>H2O2(+M) 1.20E-10 -0.4 0.0 Low pressure limit: 0.61000E-28 -0.76000E+00 0.00000E+00 SRI centering: 0.50000E+00 0.00000E+00 0.00000E+00 H2O Enhanced by 0.000E+00 65. OH+OH(+H2O)=>H2O2(+H2O) 1.20E-10 -0.4 0.0 Low pressure limit: 0.40000E-29 0.00000E+00 0.00000E+00 66. OH+HO2=H2O+O2 4.80E-11 0.0 -250.0 67. OH+H2O2=H2O+HO2 1.30E-11 0.0 670.0 68. OH+NH=NO+H2 4.00E-11 0.0 0.0 69. OH+NH=H2O+N 4.00E-11 0.0 0.0 70. OH+NH2=>O+NH3 3.30E-14 0.4 250.0 71. OH+CO=H+CO2 1.05E-17 1.5 -250.0 72. OH+CH3=H2O+CH2(S) 1.20E-11 0.0 1400.0 73. OH+CH3(+M)=CH3OH(+M) 1.00E-10 0.0 0.0 Low pressure limit: 0.44000E-03 -0.82000E+01 0.00000E+00 TROE centering: 0.82000E+00 0.20000E+03 0.14380E+04 74. OH+CH4=H2O+CH3 2.60E-17 1.8 1400.0 75. OH+HCO=H2O+CO 1.70E-10 0.0 0.0 76. OH+CH2O=H2O+HCO 5.70E-15 1.2 -225.0 77. OH+CN=>O+HCN 5.00E-11 0.0 0.0 78. OH+CN=NCO+H 5.00E-11 0.0 0.0 79. OH+HCN=>H2O+CN 1.50E-11 0.0 5400.0 80. OH+C2H2=H2O+C2H 5.00E-11 0.0 6500.0 81. OH+C2H2=H+CH2CO 5.00E-11 0.0 6500.0 82. OH+CH2CO=CH2OH+CO 8.50E-12 0.0 0.0 83. OH+CH2CO=CH2O+HCO 8.50E-12 0.0 0.0 84. H2O+M=>H+OH+M 5.80E-09 0.0 52920.0 85. HO2+HO2=H2O2+O2 7.00E-10 0.0 6030.0 86. HO2+NH2=NH3+O2 1.30E-11 0.0 0.0 87. HO2+NH2=HNO+H2O 1.30E-11 0.0 0.0 88. HO2+CH3=OH+CH3O 3.00E-11 0.0 0.0 89. HO2+CH4=H2O2+CH3 1.50E-11 0.0 12440.0 90. HO2+CH2O=H2O2+HCO 5.00E-12 0.0 6580.0 91. H2O2(+M)=>OH+OH(+M) 3.00E+14 0.0 24400.0 Low pressure limit: 0.30000E-07 0.00000E+00 0.21600E+05 SRI centering: 0.50000E+00 0.00000E+00 0.00000E+00 N2 Enhanced by 0.000E+00 92. H2O2(+N2)=>OH+OH(+N2) 3.00E+14 0.0 24400.0 Low pressure limit: 0.20000E-06 0.00000E+00 0.22900E+05 SRI centering: 0.50000E+00 0.00000E+00 0.00000E+00 93. N+O2=>NO+O 1.50E-14 1.0 3270.0 94. N+OH=>NO+H 4.70E-11 0.0 0.0 95. N+NO=>N2+O 7.10E-11 0.0 790.0 96. N+CN=>N2+C 3.00E-10 0.0 0.0 97. N+NCO=N2+CO 3.30E-11 0.0 0.0 98. NH+O2=NO+OH 6.50E-14 0.0 770.0 99. NH+O2=NO2+H 6.50E-14 0.0 770.0 100. NH+O2=HNO+O 6.50E-11 0.0 9000.0 101. NH+NO=N2O+H 9.33E-11 0.0 6400.0 102. NH+NO=NNH+O 9.33E-11 0.0 6400.0 103. NH+NO=N2+OH 9.33E-11 0.0 6400.0 104. NH2+NO=N2+H2O 7.92E-13 0.0 -650.0 105. NH2+NO=N2+H+OH 1.08E-13 0.0 -650.0 106. NH2+NO=NNH+OH 1.08E-13 0.0 -650.0 107. NH2+NO=N2O+H2 7.92E-13 0.0 -650.0 108. NH3(+M)=NH2+H(+M) 8.30E+15 0.0 55170.0 Low pressure limit: 0.74000E-08 0.00000E+00 0.41560E+05 TROE centering: 0.42000E+00 0.45810E+04 0.10200E+03 109. C+N2=>CN+N 8.70E-11 0.0 22600.0 110. C+NO=CN+O 3.20E-11 0.0 0.0 111. C+NO=>CO+N 4.80E-11 0.0 0.0 112. CH+O2=HCO+O 2.75E-11 0.0 0.0 113. CH+O2=CO+OH 2.75E-11 0.0 0.0 114. CH+H2=>CH2+H 2.40E-10 0.0 1760.0 115. CH+N2=HCN+N 2.60E-12 0.0 9030.0 116. CH+NO=CO+NH 6.67E-11 0.0 0.0 117. CH+NO=CN+OH 6.67E-11 0.0 0.0 118. CH+NO=HCN+O 6.67E-11 0.0 0.0 119. CH2+O2=CO+H+OH 8.20E-12 0.0 750.0 120. CH2+O2=CO2+H+H 8.20E-12 0.0 750.0 121. CH2+O2=CO+H2O 8.20E-12 0.0 750.0 122. CH2+O2=CO2+H2 8.20E-12 0.0 750.0 123. CH2+O2=CH2O+O 8.20E-12 0.0 750.0 124. CH2+CH2=C2H2+H2 2.00E-11 0.0 400.0 125. CH2+CH2=C2H2+2H 1.80E-10 0.0 400.0 126. CH2(S)+AR=CH2+AR 6.00E-12 0.0 0.0 127. CH2(S)+N2=CH2+N2 1.00E-11 0.0 0.0 128. CH2(S)+CH4=CH2+CH4 1.20E-11 0.0 0.0 129. CH2(S)+C2H2=CH2+C2H2 8.00E-11 0.0 0.0 130. CH2(S)+O2=CO+H+OH 1.30E-11 0.0 0.0 131. CH2(S)+O2=CO2+H2 1.30E-11 0.0 0.0 132. CH2(S)+O2=CO+H2O 1.30E-11 0.0 0.0 133. CH2(S)+O2=CH2+O2 1.30E-11 0.0 0.0 134. CH2(S)+H2=>CH3+H 1.20E-10 0.0 0.0 135. CH3+M=CH2+H+M 1.70E-08 0.0 45600.0 136. CH3+O2=>CH3O+O 2.20E-10 0.0 15800.0 137. CH3+O2=CH2O+OH 5.50E-13 0.0 4500.0 138. CH3+H2=>CH4+H 1.14E-20 2.7 4740.0 139. CH3+CH2O=CH4+HCO 1.30E-31 6.1 990.0 140. CH4(+M)=>CH3+H(+M) 2.40E+16 0.0 52800.0 Low pressure limit: 0.78000E+24 -0.82000E+01 0.59200E+05 TROE centering: 0.10000E+01 0.00000E+00 0.13500E+04 0.78300E+04 CH4 Enhanced by 0.000E+00 141. CH4(+CH4)=>CH3+H(+CH4) 2.40E+16 0.0 52800.0 Low pressure limit: 0.14000E-05 0.00000E+00 0.45700E+05 TROE centering: 0.69000E+00 0.90000E+02 0.22100E+04 142. HCO+M=>H+CO+M 2.60E-10 0.0 7930.0 143. HCO+O2=CO+HO2 2.50E-12 0.0 0.0 144. HCO+O2=OH+CO2 2.50E-12 0.0 0.0 145. HCO+HCO=CH2O+CO 5.00E-11 0.0 0.0 146. CH2O+M=H+HCO+M 8.10E+11 -5.5 48660.0 147. CH2O+M=H2+CO+M 1.89E+12 -5.5 48660.0 148. CH2OH+O2=CH2O+HO2 2.60E-09 -1.0 0.0 Declared duplicate reaction... 149. CH2OH+O2=CH2O+HO2 1.20E-10 0.0 1800.0 Declared duplicate reaction... 150. CH3O+M=CH2O+H+M 9.00E-11 0.0 6790.0 151. CH3O+O2=CH2O+HO2 3.60E-14 0.0 880.0 152. CN+O2=>NCO+O 1.20E-11 0.0 -210.0 153. CN+H2=HCN+H 3.20E-20 2.9 820.0 154. CN+H2O=>HCN+OH 6.50E-12 0.0 3750.0 155. CN+H2O=HOCN+H 6.50E-12 0.0 3750.0 156. CN+CH4=HCN+CH3 1.50E-19 2.6 -150.0 157. NCO+M=N+CO+M 1.70E-09 0.0 23500.0 158. NCO+NO=N2O+CO 7.67E-07 -1.7 380.0 159. NCO+NO=N2+CO2 7.67E-07 -1.7 380.0 160. NCO+NO=N2+CO+O 7.67E-07 -1.7 380.0 161. C2H+O2=CO2+CH 7.50E-12 0.0 0.0 162. C2H+O2=2CO+H 7.50E-12 0.0 0.0 163. C2H+O2=CO+HCO 7.50E-12 0.0 0.0 164. C2H+H2=>C2H2+H 1.80E-11 0.0 1090.0 165. HCCO+O2=CO2+HCO 6.75E-13 0.0 430.0 166. HCCO+O2=2CO+OH 6.75E-13 0.0 430.0 167. HCCO+O2=C2O+HO2 6.75E-13 0.0 430.0 NOTE: E units Kelvin, A units molecules NO ERRORS FOUND ON INPUT...CHEMKIN LINKING FILE WRITTEN. WORKING SPACE REQUIREMENTS ARE INTEGER: 2918 REAL: 2854 CHARACTER: 47