ThermoModelResult Class Reference

The result of a thermodynamic model function that calculates standard thermodynamic properties of species. More...

#include <ThermoModel.hpp>

Public Member Functions
	ThermoModelResult ()
	Construct a default ThermoModelResult instance.
	ThermoModelResult (Index nphases, Index nspecies)
	Construct a ThermoModelResult instance with allocated memory. More...
auto	resize (Index nphases, Index nspecies) -> void
	Resize this ThermoModelResult with a given number of species. More...
auto	phaseProperties (Index iphase, Index ispecies, Index nspecies) -> PhaseThermoModelResult
	Return a view of the thermodynamic properties of a phase. More...
auto	phaseProperties (Index iphase, Index ispecies, Index nspecies) const -> PhaseThermoModelResultConst
	Return a view of the thermodynamic properties of a phase. More...
auto	standardPartialMolarGibbsEnergies () -> ThermoVectorRef
	The standard partial molar Gibbs energies of the species (in units of J/mol).
auto	standardPartialMolarGibbsEnergies () const -> ThermoVectorConstRef
	The standard partial molar Gibbs energies of the species (in units of J/mol).
auto	standardPartialMolarEnthalpies () -> ThermoVectorRef
	The standard partial molar enthalpies of the species (in units of J/mol).
auto	standardPartialMolarEnthalpies () const -> ThermoVectorConstRef
	The standard partial molar enthalpies of the species (in units of J/mol).
auto	standardPartialMolarVolumes () -> ThermoVectorRef
	The standard partial molar volumes of the species (in units of m3/mol).
auto	standardPartialMolarVolumes () const -> ThermoVectorConstRef
	The standard partial molar volumes of the species (in units of m3/mol).
auto	standardPartialMolarHeatCapacitiesConstP () -> ThermoVectorRef
	The standard partial molar isobaric heat capacities of the species (in units of J/(mol*K)).
auto	standardPartialMolarHeatCapacitiesConstP () const -> ThermoVectorConstRef
	The standard partial molar isobaric heat capacities of the species (in units of J/(mol*K)).
auto	standardPartialMolarHeatCapacitiesConstV () -> ThermoVectorRef
	The standard partial molar isochoric heat capacities of the species (in units of J/(mol*K)).
auto	standardPartialMolarHeatCapacitiesConstV () const -> ThermoVectorConstRef
	The standard partial molar isochoric heat capacities of the species (in units of J/(mol*K)).
auto	lnActivityConstants () -> ThermoVectorRef
	The natural log of the activity constants of the species.
auto	lnActivityConstants () const -> ThermoVectorConstRef
	The natural log of the activity constants of the species.

Detailed Description

The result of a thermodynamic model function that calculates standard thermodynamic properties of species.

Constructor & Destructor Documentation

ThermoModelResult()

ThermoModelResult	(	Index	nphases,
		Index	nspecies
	)

Construct a ThermoModelResult instance with allocated memory.

Parameters

nphases	The number of phases in the chemical system.
nspecies	The number of species in the chemical system.

Member Function Documentation

resize()

auto resize	(	Index	nphases,
		Index	nspecies
	)		-> void

Resize this ThermoModelResult with a given number of species.

Parameters

nphases	The number of phases in the chemical system.
nspecies	The number of species in the chemical system.

phaseProperties() [1/2]

auto phaseProperties	(	Index	iphase,
		Index	ispecies,
		Index	nspecies
	)		-> PhaseThermoModelResult

Return a view of the thermodynamic properties of a phase.

Parameters

iphase	The index of the phase.
ispecies	The index of the first species in the phase.
nspecies	The number of species in the phase.

phaseProperties() [2/2]

auto phaseProperties	(	Index	iphase,
		Index	ispecies,
		Index	nspecies
	)		const -> PhaseThermoModelResultConst

Return a view of the thermodynamic properties of a phase.

Parameters

iphase	The index of the phase.
ispecies	The index of the first species in the phase.
nspecies	The number of species in the phase.

---

The documentation for this class was generated from the following files:

• Reaktoro/Thermodynamics/Models/ThermoModel.hpp
• Reaktoro/Thermodynamics/Models/ThermoModel.cpp