2f5bf8b7fb
It does add tests for the calculation of equilibrium constants for fractional coefficient reactions.
31 lines
688 B
Text
31 lines
688 B
Text
Number of species = 6
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Number of reactions = 2
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fwd_rop[0] = 3.04665e+10
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fwd_rop[1] = 1.57504e-08
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0 H2 -1.10253e-08
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1 H 4.2653e+10
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2 O nil
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3 O2 6.09329e+09
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4 OH 1.82799e+10
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5 H2O -3.04665e+10
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Creation Rates:
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0 H2 0 0
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1 H 4.2653e+10 1.4
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2 O 0 0
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3 O2 6.09329e+09 0.2
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4 OH 1.82799e+10 0.6
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5 H2O 1.57504e-08 1
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Destruction Rates:
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0 H2 1.10253e-08 0.7
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1 H 0 0
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2 O 0 0
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3 O2 3.15009e-09 0.2
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4 OH 9.45026e-09 0.6
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5 H2O 3.04665e+10 1
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kf[0] = 1e+13
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kf[1] = 39810.7
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equal numbers 0: 3.04665e+10 3.04665e+10
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equal numbers 1: 1.57504e-08 1.57504e-08
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Equilibrium constants for irreversible fractional rxns:
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Kc[0] = 5.60014e-11
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Kc[1] = 62705
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