MineralMixture Class Reference

Provide a computational representation of a mineral mixture. More...

#include <MineralMixture.hpp>

Inheritance diagram for MineralMixture:

Collaboration diagram for MineralMixture:

Public Member Functions
	MineralMixture ()
	Construct a default MineralMixture instance.
	MineralMixture (const std::vector< MineralSpecies > &species)
	Construct a MineralMixture instance with given species. More...
	MineralMixture (const MineralSpecies &species)
	Construct a MineralMixture instance with a single species. More...
virtual	~MineralMixture ()
	Destroy the MineralMixture instance.
auto	state (Temperature T, Pressure P, VectorConstRef n) const -> MineralMixtureState
	Calculate the state of the mineral mixture. More...
Public Member Functions inherited from GeneralMixture< MineralSpecies >
	GeneralMixture ()
	Construct a default GeneralMixture instance.
	GeneralMixture (const std::vector< MineralSpecies > &species)
	Construct a GeneralMixture instance with given species. More...
virtual	~GeneralMixture ()
	Destroy the instance.
auto	setName (std::string name) -> void
	Set the name of the mixture.
auto	numSpecies () const -> unsigned
	Return the number of species in the mixture.
auto	name () const -> std::string
	Return the name of the mixture.
auto	species () const -> const std::vector< MineralSpecies > &
	Return the species that compose the mixture. More...
auto	species (const Index &index) const -> const MineralSpecies &
	Return a species in the mixture. More...
auto	indexSpecies (const std::string &name) const -> Index
	Return the index of a species in the mixture. More...
auto	indexSpeciesAny (const std::vector< std::string > &names) const -> Index
	Return the index of the first species in the mixture with any of the given names. More...
auto	namesSpecies () const -> std::vector< std::string >
	Return the names of the species in the mixture.
auto	chargesSpecies () const -> Vector
	Return the charges of the species in the mixture.
auto	moleFractions (VectorConstRef n) const -> ChemicalVector
	Calculates the mole fractions of the species and their partial derivatives. More...
auto	state (Temperature T, Pressure P, VectorConstRef n) const -> MixtureState
	Calculate the state of the mixture. More...

Detailed Description

Provide a computational representation of a mineral mixture.

The MineralMixture class is defined as a collection of MineralSpecies objects, representing, therefore, a mixture of mineral species. Its main purpose is to provide the necessary operations in the calculation of activities of mineral species.

See also

MineralSpecies

Constructor & Destructor Documentation

MineralMixture() [1/2]

MineralMixture ( const std::vector< MineralSpecies > &  species )

explicit

Construct a MineralMixture instance with given species.

Parameters

species

The species that compose the mineral mixture

MineralMixture() [2/2]

MineralMixture ( const MineralSpecies &  species )

explicit

Construct a MineralMixture instance with a single species.

Parameters

species

The species that compose the mineral mixture

Member Function Documentation

state()

auto state	(	Temperature	T,
		Pressure	P,
		VectorConstRef	n
	)		const -> MineralMixtureState

Calculate the state of the mineral mixture.

Parameters

T	The temperature (in units of K)
P	The pressure (in units of Pa)
n	The molar amounts of the species in the mixture (in units of mol)

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

• Reaktoro/Thermodynamics/Mixtures/MineralMixture.hpp
• Reaktoro/Thermodynamics/Mixtures/MineralMixture.cpp