The options for smart chemical kinetics calculation. More...

Collaboration diagram for SmartKineticsOptions:

Public Member Functions
	SmartKineticsOptions ()=default
	Construct a default SmartKineticsOptions object.

	SmartKineticsOptions (SmartEquilibriumOptions const &other)
	Construct a SmartKineticsOptions object from a SmartEquilibriumOptions one.

Additional Inherited Members
Public Attributes inherited from SmartEquilibriumOptions
EquilibriumOptions	learning
	The options for the chemical equilibrium calculations during learning operations.

double	reltol_negative_amounts = -1.0e-14
	The relative tolerance for negative species amounts when predicting with first-order Taylor approximation. More...

double	reltol_component_amount_conservation = 1.0e-10
	The relative tolerance used for the amount of species in the conservation of mass constraint.

double	reltol = 0.005
	The relative tolerance used in the acceptance test for the predicted chemical equilibrium state.

double	abstol = 0.01
	The absolute tolerance used in the acceptance test for the predicted chemical equilibrium state.

double	temperature_step = 10.0
	The step length used to discretize temperature in the temperature-pressure space when storing learned calculations (in K).

double	pressure_step = 25.0e+5
	The step length used to discretize pressure in the temperature-pressure space when storing learned calculations (in Pa).

Detailed Description

The options for smart chemical kinetics calculation.

The documentation for this struct was generated from the following file:

Public Member Functions