Importing the Complex Chemistry Definition
Import the complex chemistry definition from Chemkin-formatted files.
-
Copy the following files from the
reactingFlow/surfChemMethanePt/ folder of the downloaded tutorial files to the directory where
methaneOnPt.sim is located (your working directory):
- chem.inp
- surf.inp
- surf-therm.dat
- therm.dat
- tran.dat
The two chemkin files chem.inp and surf.inp define the surface/gas chemistry mechanism. Thermodynamic data comes from therm.dat for species in the gas phase, and from surf-therm.dat for species in the surface phase. The file tran.dat has molecular transport data.
The next step is to bring the Chemkin-formatted files into the simulation.
- Right-click the node and select .
-
In the
Import Chemkin Files dialog:
- Save the simulation.