pmutt.io.chemkin.read_reactions

pmutt.io.chemkin.read_reactions(filename, species=None)

Directly read reactions from Chemkin gas.inp or surf.inp files

Parameters:

• filename (str) – Input filename for Chemkin surf or gas .inp file

• species (list of Nasa objects) – List of NASA objects containing thermodynamic properties for all Reactants and Products in Reactions default = None. Will not return React_obj and Prod_obj

Returns:

• Reactions (list of reactions)

• Reactants (list of reactants found in reactions)

• React_obj (list of NASA polynomials for each Reactant) – If species object list is supplied

• React_stoic (list of reaction stoichiometries for Reactants)

• Products (list of products found in reactions)

• Prod_obj (list of NASA polynomials for each Product) – If species object list is supplied

• Prod_stoic (list of reaction stoichiometries for Products)

Raises:

• FileNotFoundError – If the surf.inp or gas.inp file isn’t found.

• NameError – If the species file does not exist

• AttributeError – If the species list is incorrect format