diff --git a/include/cantera/transport/TransportData.h b/include/cantera/transport/TransportData.h index a52b73b47..5a7307576 100644 --- a/include/cantera/transport/TransportData.h +++ b/include/cantera/transport/TransportData.h @@ -29,6 +29,7 @@ class GasTransportData : public TransportData public: GasTransportData(); + //! Construct a GasTransportData object using MKS units for all parameters. GasTransportData(const std::string& geometry, double diameter, double well_depth, double dipole=0.0, double polarizability=0.0, double rot_relax=0.0, @@ -42,6 +43,10 @@ public: double polarizability=0.0, double rot_relax=0.0, double acentric=0.0); + //! Check transport data for invalid parameters such as a geometry + //! inconsistent with the atomic composition, non-positive diameter, or + //! negative values for well depth, dipole, polarizability, or + //! rotational relaxation number. virtual void validate(const Species& species); //! A string specifying the molecular geometry. One of `atom`, `linear`, or @@ -65,7 +70,7 @@ public: //! Default 0.0. double rotational_relaxation; - // Pitzer's acentric factor [dimensionless]. Default 0.0. + //! Pitzer's acentric factor [dimensionless]. Default 0.0. double acentric_factor; };