61 lines
1.9 KiB
Text
61 lines
1.9 KiB
Text
units(length = "cm", time = "s", quantity = "mol", act_energy = "cal/mol")
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ideal_gas(name = "air",
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elements = " O H N Ar ",
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species = """ gri30: O O2 N NO NO2 N2O N2 NH H H2O NH2 AR """,
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reactions = "all",
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transport = "Mix",
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initial_state = state(temperature = 900.0,
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pressure = OneAtm, mole_fractions = 'O2:0.21, N2:0.78, AR:0.01') )
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#-------------------------------------------------------------------------------
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# Reeaction 77
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# 10.5, 9 (a)
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# Miller & Melius, 24th Symp. on Comb., 1992.
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reaction( "NH + NO <=> N2O + H", [2.94000E+14, -0.4, 0],
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options = ["duplicate"])
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# Reaction 78
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reaction( "NH + NO <=> N2O + H", [-2.16000E+13, -0.23, 0],
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options = ["negative_A", "duplicate"])
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# Second Reaction:
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# Reaction 90
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# 10.6, 9 (b)
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# Glarborg et al., Int. J. Chem. Kinet., 26, 421, 1994.
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reaction( "NH2 + NO <=> N2 + H2O", [1.30000E+16, -1.25, 0],
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options = ["duplicate"])
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# Reaction 91
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reaction( "NH2 + NO <=> N2 + H2O", [-2.80000E+13, -0.55, 0],
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options = ["negative_A", "duplicate"])
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#-------------------------------------------------------------------------------
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# Reaction 1
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three_body_reaction( "2 O + M <=> O2 + M", [1.20000E+17, -1, 0],
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efficiencies = " AR:0.83 ")
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# Reaction 2
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reaction( "N + NO <=> N2 + O", [2.70000E+13, 0, 355])
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# Reaction 3
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reaction( "N + O2 <=> NO + O", [9.00000E+09, 1, 6500])
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# Reaction 4
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reaction( "N2O + O <=> N2 + O2", [1.40000E+12, 0, 10810])
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# Reaction 5
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reaction( "N2O + O <=> 2 NO", [2.90000E+13, 0, 23150])
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# Reaction 6
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falloff_reaction( "N2O (+ M) <=> N2 + O (+ M)",
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kf = [7.91000E+10, 0, 56020],
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kf0 = [6.37000E+14, 0, 56640],
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efficiencies = " AR:0.625 ")
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# Reaction 7
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three_body_reaction( "NO + O + M <=> NO2 + M", [1.06000E+20, -1.41, 0],
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efficiencies = " AR:0.7 ")
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# Reaction 8
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reaction( "NO2 + O <=> NO + O2", [3.90000E+12, 0, -240])
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