Tutorial 1: Getting started gri30: temperature 300 K pressure 101325 Pa density 0.081889 kg/m^3 mean mol. weight 2.01588 amu 1 kg 1 kmol ----------- ------------ enthalpy 26470.1 5.336e+04 J internal energy -1.21088e+06 -2.441e+06 J entropy 64914 1.309e+05 J/K Gibbs function -1.94477e+07 -3.92e+07 J heat capacity c_p 14311.8 2.885e+04 J/K heat capacity c_v 10187.3 2.054e+04 J/K X Y Chem. Pot. / RT ------------- ------------ ------------ H2 1 1 -15.7173 H 0 0 O 0 0 O2 0 0 OH 0 0 H2O 0 0 HO2 0 0 H2O2 0 0 C 0 0 CH 0 0 CH2 0 0 CH2(S) 0 0 CH3 0 0 CH4 0 0 CO 0 0 CO2 0 0 HCO 0 0 CH2O 0 0 CH2OH 0 0 CH3O 0 0 CH3OH 0 0 C2H 0 0 C2H2 0 0 C2H3 0 0 C2H4 0 0 C2H5 0 0 C2H6 0 0 HCCO 0 0 CH2CO 0 0 HCCOH 0 0 N 0 0 NH 0 0 NH2 0 0 NH3 0 0 NNH 0 0 NO 0 0 NO2 0 0 N2O 0 0 HNO 0 0 CN 0 0 HCN 0 0 H2CN 0 0 HCNN 0 0 HCNO 0 0 HOCN 0 0 HNCO 0 0 NCO 0 0 N2 0 0 AR 0 0 C3H7 0 0 C3H8 0 0 CH2CHO 0 0 CH3CHO 0 0 gri30: temperature 1200 K pressure 405300 Pa density 0.081889 kg/m^3 mean mol. weight 2.01588 amu 1 kg 1 kmol ----------- ------------ enthalpy 1.32956e+07 2.68e+07 J internal energy 8.3462e+06 1.682e+07 J entropy 79509.9 1.603e+05 J/K Gibbs function -8.21163e+07 -1.655e+08 J heat capacity c_p 15377.9 3.1e+04 J/K heat capacity c_v 11253.5 2.269e+04 J/K X Y Chem. Pot. / RT ------------- ------------ ------------ H2 1 1 -16.5912 H 0 0 O 0 0 O2 0 0 OH 0 0 H2O 0 0 HO2 0 0 H2O2 0 0 C 0 0 CH 0 0 CH2 0 0 CH2(S) 0 0 CH3 0 0 CH4 0 0 CO 0 0 CO2 0 0 HCO 0 0 CH2O 0 0 CH2OH 0 0 CH3O 0 0 CH3OH 0 0 C2H 0 0 C2H2 0 0 C2H3 0 0 C2H4 0 0 C2H5 0 0 C2H6 0 0 HCCO 0 0 CH2CO 0 0 HCCOH 0 0 N 0 0 NH 0 0 NH2 0 0 NH3 0 0 NNH 0 0 NO 0 0 NO2 0 0 N2O 0 0 HNO 0 0 CN 0 0 HCN 0 0 H2CN 0 0 HCNN 0 0 HCNO 0 0 HOCN 0 0 HNCO 0 0 NCO 0 0 N2 0 0 AR 0 0 C3H7 0 0 C3H8 0 0 CH2CHO 0 0 CH3CHO 0 0 gri30: temperature 900 K pressure 100000 Pa density 0.369279 kg/m^3 mean mol. weight 27.6332 amu 1 kg 1 kmol ----------- ------------ enthalpy 455660 1.259e+07 J internal energy 184862 5.108e+06 J entropy 8529.31 2.357e+05 J/K Gibbs function -7.22072e+06 -1.995e+08 J heat capacity c_p 1304.4 3.604e+04 J/K heat capacity c_v 1003.52 2.773e+04 J/K X Y Chem. Pot. / RT ------------- ------------ ------------ H2 0 0 H 0 0 O 0 0 O2 0.190114 0.220149 -27.9596 OH 0 0 H2O 0 0 HO2 0 0 H2O2 0 0 C 0 0 CH 0 0 CH2 0 0 CH2(S) 0 0 CH3 0 0 CH4 0.095057 0.0551863 -37.0813 CO 0 0 CO2 0 0 HCO 0 0 CH2O 0 0 CH2OH 0 0 CH3O 0 0 CH3OH 0 0 C2H 0 0 C2H2 0 0 C2H3 0 0 C2H4 0 0 C2H5 0 0 C2H6 0 0 HCCO 0 0 CH2CO 0 0 HCCOH 0 0 N 0 0 NH 0 0 NH2 0 0 NH3 0 0 NNH 0 0 NO 0 0 NO2 0 0 N2O 0 0 HNO 0 0 CN 0 0 HCN 0 0 H2CN 0 0 HCNN 0 0 HCNO 0 0 HOCN 0 0 HNCO 0 0 NCO 0 0 N2 0.714829 0.724665 -24.935 AR 0 0 C3H7 0 0 C3H8 0 0 CH2CHO 0 0 CH3CHO 0 0 gri30: temperature 1235.23 K pressure 193934 Pa density 0.545252 kg/m^3 mean mol. weight 28.8752 amu 1 kg 1 kmol ----------- ------------ enthalpy 5.56724e+06 1.608e+08 J internal energy 5.21156e+06 1.505e+08 J entropy 10866.6 3.138e+05 J/K Gibbs function -7.85549e+06 -2.268e+08 J heat capacity c_p 2258.12 6.52e+04 J/K heat capacity c_v 1970.18 5.689e+04 J/K X Y Chem. Pot. / RT ------------- ------------ ------------ H2 0.0188679 0.00131724 -21.3768 H 0.0188679 0.000658618 2.45072 O 0.0188679 0.0104545 -0.130264 O2 0.0188679 0.020909 -30.495 OH 0.0188679 0.0111131 -23.9578 H2O 0.0188679 0.0117717 -52.4329 HO2 0.0188679 0.0215676 -32.8359 H2O2 0.0188679 0.0222262 -48.7862 C 0.0188679 0.00784834 45.7869 CH 0.0188679 0.00850696 30.4521 CH2 0.0188679 0.00916558 8.43598 CH2(S) 0.0188679 0.00916558 12.8299 CH3 0.0188679 0.0098242 -16.0065 CH4 0.0188679 0.0104828 -36.8745 CO 0.0188679 0.0183028 -40.2646 CO2 0.0188679 0.0287573 -70.9103 HCO 0.0188679 0.0189614 -29.3505 CH2O 0.0188679 0.0196201 -43.7869 CH2OH 0.0188679 0.0202787 -38.854 CH3O 0.0188679 0.0202787 -33.4663 CH3OH 0.0188679 0.0209373 -56.6067 C2H 0.0188679 0.0163553 22.4849 C2H2 0.0188679 0.0170139 -9.62065 C2H3 0.0188679 0.0176725 -6.88586 C2H4 0.0188679 0.0183312 -29.6415 C2H5 0.0188679 0.0189898 -27.3078 C2H6 0.0188679 0.0196484 -45.4153 HCCO 0.0188679 0.0268098 -20.3438 CH2CO 0.0188679 0.0274684 -42.3074 HCCOH 0.0188679 0.0274684 -29.6958 N 0.0188679 0.00915242 22.608 NH 0.0188679 0.00981104 7.2794 NH2 0.0188679 0.0104697 -11.0016 NH3 0.0188679 0.0111283 -34.4022 NNH 0.0188679 0.0189635 -9.19194 NO 0.0188679 0.0196069 -22.2473 NO2 0.0188679 0.0300614 -32.3728 N2O 0.0188679 0.0287593 -25.4986 HNO 0.0188679 0.0202655 -22.6121 CN 0.0188679 0.0170008 12.6004 HCN 0.0188679 0.0176594 -18.1967 H2CN 0.0188679 0.018318 -10.0875 HCNN 0.0188679 0.0268118 6.88522 HCNO 0.0188679 0.0281139 -20.4444 HOCN 0.0188679 0.0281139 -37.9279 HNCO 0.0188679 0.0281139 -48.2213 NCO 0.0188679 0.0274552 -22.1878 N2 0.0188679 0.0183048 -28.7463 AR 0.0188679 0.0261032 -23.5881 C3H7 0.0188679 0.0281554 -36.9365 C3H8 0.0188679 0.028814 -55.0607 CH2CHO 0.0188679 0.028127 -38.8293 CH3CHO 0.0188679 0.0287856 -57.467 gri30: temperature 1235.23 K pressure 368222 Pa density 0.545252 kg/m^3 mean mol. weight 15.2079 amu 1 kg 1 kmol ----------- ------------ enthalpy 1.26294e+07 1.921e+08 J internal energy 1.19541e+07 1.818e+08 J entropy 15645.4 2.379e+05 J/K Gibbs function -6.69611e+06 -1.018e+08 J heat capacity c_p 2918.61 4.439e+04 J/K heat capacity c_v 2371.89 3.607e+04 J/K X Y Chem. Pot. / RT ------------- ------------ ------------ H2 0.14234 0.0188679 -18.7148 H 0.284681 0.0188679 5.8058 O 0.0179345 0.0188679 0.460166 O2 0.00896725 0.0188679 -30.5977 OH 0.0168716 0.0188679 -23.4285 H2O 0.0159277 0.0188679 -51.9612 HO2 0.00869341 0.0188679 -32.9696 H2O2 0.0084358 0.0188679 -48.95 C 0.0238899 0.0188679 46.664 CH 0.0220403 0.0188679 31.2487 CH2 0.0204565 0.0188679 9.15798 CH2(S) 0.0204565 0.0188679 13.5519 CH3 0.0190851 0.0188679 -15.3539 CH4 0.017886 0.0188679 -36.2868 CO 0.0102441 0.0188679 -40.2341 CO2 0.00651994 0.0188679 -71.3318 HCO 0.00988827 0.0188679 -29.3554 CH2O 0.00955633 0.0188679 -43.8259 CH2OH 0.00924596 0.0188679 -38.9261 CH3O 0.00924596 0.0188679 -33.5384 CH3OH 0.00895511 0.0188679 -56.7108 C2H 0.0114639 0.0188679 22.6278 C2H2 0.0110201 0.0188679 -9.51722 C2H3 0.0106094 0.0188679 -6.8204 C2H4 0.0102283 0.0188679 -29.6127 C2H5 0.00987352 0.0188679 -27.3142 C2H6 0.00954255 0.0188679 -45.4558 HCCO 0.00699356 0.0188679 -20.6951 CH2CO 0.00682587 0.0188679 -42.6829 HCCOH 0.00682587 0.0188679 -30.0714 N 0.0204859 0.0188679 23.3314 NH 0.0191107 0.0188679 7.93336 NH2 0.0179085 0.0188679 -10.4126 NH3 0.0168486 0.0188679 -33.8742 NNH 0.00988722 0.0188679 -9.19699 NO 0.00956275 0.0188679 -22.2857 NO2 0.0062371 0.0188679 -32.8386 N2O 0.00651948 0.0188679 -25.9201 HNO 0.00925196 0.0188679 -22.6835 CN 0.0110287 0.0188679 12.7046 HCN 0.0106174 0.0188679 -18.1305 H2CN 0.0102356 0.0188679 -10.0579 HCNN 0.00699304 0.0188679 6.53384 HCNO 0.00666916 0.0188679 -20.8432 HOCN 0.00666916 0.0188679 -38.3267 HNCO 0.00666916 0.0188679 -48.6201 NCO 0.00682915 0.0188679 -22.5629 N2 0.010243 0.0188679 -28.716 AR 0.00718287 0.0188679 -23.9127 C3H7 0.00665933 0.0188679 -37.3368 C3H8 0.00650712 0.0188679 -55.4841 CH2CHO 0.00666604 0.0188679 -39.2286 CH3CHO 0.00651352 0.0188679 -57.8894