ReactionThermoInterpolatedProperties Struct Reference

A type for storing thermodynamic properties of a reaction over a range of temperatures and pressures. More...

#include <ThermoData.hpp>

Inheritance diagram for ReactionThermoInterpolatedProperties:

Collaboration diagram for ReactionThermoInterpolatedProperties:

Public Attributes
ReactionEquation	equation
	The equation of the reaction as pairs (reactant, stoichiometry)
BilinearInterpolator	lnk
	The interpolator of the equilibrium constant \(\ln k_{\mathrm{eq}}\) of the reaction.
Public Attributes inherited from SpeciesThermoInterpolatedProperties
BilinearInterpolator	gibbs_energy
	The interpolator of the standard molar Gibbs free energy \(\Delta G_{f}^{\circ}\) of the species (in units of J/mol)
BilinearInterpolator	helmholtz_energy
	The interpolator of the standard molar Helmholtz free energy \(\Delta A_{f}^{\circ}\) of the species (in units of J/mol)
BilinearInterpolator	internal_energy
	The interpolator of the standard molar internal energy \(\Delta U_{f}^{\circ}\) of the species (in units of J/mol)
BilinearInterpolator	enthalpy
	The interpolator of the standard molar enthalpy \(\Delta H_{f}^{\circ}\) of the species (in units of J/mol)
BilinearInterpolator	entropy
	The interpolator of the standard molar entropy \( S^{\circ}\) of the species (in units of J/K)
BilinearInterpolator	volume
	The interpolator of the standard molar volume \( V^{\circ}\) of the species (in units of m3/mol)
BilinearInterpolator	heat_capacity_cp
	The interpolator of the standard molar isobaric heat capacity \( C_{P}^{\circ}\) of the species (in units of J/(mol*K))
BilinearInterpolator	heat_capacity_cv
	The interpolator of the standard molar isochoric heat capacity \( C_{V}^{\circ}\) of the species (in units of J/(mol*K))

Detailed Description

A type for storing thermodynamic properties of a reaction over a range of temperatures and pressures.

The thermodynamic properties are represented by BilinearInterpolator instances, where the temperature points (in units of K) are along the x-coordinates, and the pressure points (in units of Pa) are along the y-coordinates.

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

• Reaktoro/Thermodynamics/Species/ThermoData.hpp