diff --git a/doc/sphinx/cti/phases.rst b/doc/sphinx/cti/phases.rst index e57aa3407..919fd528e 100644 --- a/doc/sphinx/cti/phases.rst +++ b/doc/sphinx/cti/phases.rst @@ -309,13 +309,7 @@ If we import this into Matlab, for example, we get a gas mixture containing the X Y Chem. Pot. / RT ------------- ------------ ------------ H2 1 1 -917934 - H 0 0 - O 0 0 - O2 0 0 - OH 0 0 - H2O 0 0 - HO2 0 0 - H2O2 0 0 + [ +7 minor] 0 0 >> eqs = reactionEqn(gas) diff --git a/doc/sphinx/cython/tutorial.rst b/doc/sphinx/cython/tutorial.rst index 077e31034..e814d7dd1 100644 --- a/doc/sphinx/cython/tutorial.rst +++ b/doc/sphinx/cython/tutorial.rst @@ -42,58 +42,7 @@ You should see something like this:: 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 + [ +52 minor] 0 0 What you have just done is to create an object, `gas1` that implements GRI- Mech 3.0, the 53-species, 325-reaction natural gas combustion mechanism @@ -143,7 +92,7 @@ uses SI units). After this statement, calling ``gas1()`` results in:: X Y Chem. Pot. / RT ------------- ------------ ------------ H2 1 1 -17.9775 - (other species not shown) + [ +52 minor] 0 0 Notice that the temperature has been changed as requested, but the pressure has changed too. The density and composition have not. @@ -205,59 +154,10 @@ results in:: X Y Chem. Pot. / RT ------------- ------------ ------------ - H2 0 0 - H 0 0 - O 0 0 O2 0.190114 0.220149 -28.7472 - 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 -35.961 - 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 -25.6789 - AR 0 0 - C3H7 0 0 - C3H8 0 0 - CH2CHO 0 0 - CH3CHO 0 0 + [ +50 minor] 0 0 The composition above was specified using a string. The format is a comma- separated list of ``:`` pairs. The mole diff --git a/samples/matlab/tut1.m b/samples/matlab/tut1.m index ef107fbe8..a9011ec7f 100644 --- a/samples/matlab/tut1.m +++ b/samples/matlab/tut1.m @@ -30,58 +30,7 @@ gas1 = GRI30 % 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 +% [ +52 minor] 0 0 % % What you have just done is to create an object ("gas1") that % implements GRI-Mech 3.0, the 53-species, 325-reaction natural gas @@ -179,59 +128,10 @@ set(gas1,'T',900.0,'P',1.e5,'X','CH4:1,O2:2,N2:7.52') % % 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 +% [ +50 minor] 0 0 % Other properties may also be set using 'set', including some that % can't be set individually. The following property pairs may be