IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate > Class Template Reference

Simple extension of Reaction to handle irreversible reactions. More...

Inheritance diagram for IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >:

Collaboration diagram for IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >:

Public Member Functions
	TypeName ("irreversible")
	Runtime type information. More...
	IrreversibleReaction (const ReactionType< ReactionThermo > &reaction, const ReactionRate &reactionRate)
	Construct from components. More...
	IrreversibleReaction (const IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate > &, const speciesTable &species)
	Construct as copy given new speciesTable. More...
	IrreversibleReaction (const speciesTable &species, const HashPtrTable< ReactionThermo > &thermoDatabase, const dictionary &dict)
	Construct from dictionary. More...
virtual autoPtr< Reaction< ReactionThermo > >	clone () const
	Construct and return a clone. More...
virtual autoPtr< Reaction< ReactionThermo > >	clone (const speciesTable &species) const
	Construct and return a clone with new speciesTable. More...
virtual	~IrreversibleReaction ()
	Destructor. More...
virtual scalar	kf (const scalar p, const scalar T, const scalarField &c) const
	Forward rate constant. More...
virtual scalar	kr (const scalar kfwd, const scalar p, const scalar T, const scalarField &c) const
	Reverse rate constant from the given forward rate constant. More...
virtual scalar	kr (const scalar p, const scalar T, const scalarField &c) const
	Reverse rate constant. More...
virtual scalar	dkfdT (const scalar p, const scalar T, const scalarField &c) const
	Temperature derivative of forward rate. More...
virtual scalar	dkrdT (const scalar p, const scalar T, const scalarField &c, const scalar dkfdT, const scalar kr) const
	Temperature derivative of reverse rate. More...
virtual const List< Tuple2< label, scalar > > &	beta () const
	Third-body efficiencies (beta = 1-alpha) More...
virtual void	dcidc (const scalar p, const scalar T, const scalarField &c, scalarField &dcidc) const
	Species concentration derivative of the pressure dependent term. More...
virtual scalar	dcidT (const scalar p, const scalar T, const scalarField &c) const
	Temperature derivative of the pressure dependent term. More...
virtual void	write (Ostream &) const
	Write. More...

Detailed Description

template<template< class > class ReactionType, class ReactionThermo, class ReactionRate>
class Foam::IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >

Simple extension of Reaction to handle irreversible reactions.

Source files

• IrreversibleReaction.H
• IrreversibleReaction.C

Definition at line 54 of file IrreversibleReaction.H.

Constructor & Destructor Documentation

IrreversibleReaction() [1/3]

IrreversibleReaction	(	const ReactionType< ReactionThermo > &	reaction,
		const ReactionRate &	reactionRate
	)

Construct from components.

Definition at line 38 of file IrreversibleReaction.C.

Referenced by IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::IrreversibleReaction().

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IrreversibleReaction() [2/3]

IrreversibleReaction	(	const IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate > &	irr,
		const speciesTable &	species
	)

Construct as copy given new speciesTable.

Definition at line 75 of file IrreversibleReaction.C.

IrreversibleReaction() [3/3]

IrreversibleReaction	(	const speciesTable &	species,
		const HashPtrTable< ReactionThermo > &	thermoDatabase,
		const dictionary &	dict
	)

Construct from dictionary.

Definition at line 56 of file IrreversibleReaction.C.

References IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::IrreversibleReaction().

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~IrreversibleReaction()

virtual ~IrreversibleReaction ( )

inlinevirtual

Destructor.

Definition at line 149 of file IrreversibleReaction.H.

References IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::beta(), Foam::constant::universal::c, IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::dcidc(), IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::dcidT(), IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::dkfdT(), IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::dkrdT(), IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::kf(), IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::kr(), p, Foam::T(), and IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::write().

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Member Function Documentation

TypeName()

TypeName

(

"irreversible"

)

Runtime type information.

clone() [1/2]

virtual autoPtr<Reaction<ReactionThermo> > clone ( ) const

inlinevirtual

Construct and return a clone.

Definition at line 113 of file IrreversibleReaction.H.

clone() [2/2]

virtual autoPtr<Reaction<ReactionThermo> > clone ( const speciesTable &  species ) const

inlinevirtual

Construct and return a clone with new speciesTable.

Definition at line 128 of file IrreversibleReaction.H.

kf()

Foam::scalar kf ( const scalar  p, const scalar  T, const scalarField &  c  ) const

virtual

Forward rate constant.

Definition at line 99 of file IrreversibleReaction.C.

Referenced by IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::~IrreversibleReaction().

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kr() [1/2]

Foam::scalar kr ( const scalar  kfwd, const scalar  p, const scalar  T, const scalarField &  c  ) const

virtual

Reverse rate constant from the given forward rate constant.

Returns 0

Definition at line 121 of file IrreversibleReaction.C.

Referenced by IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::~IrreversibleReaction().

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kr() [2/2]

Foam::scalar kr ( const scalar  p, const scalar  T, const scalarField &  c  ) const

virtual

Reverse rate constant.

Returns 0

Definition at line 144 of file IrreversibleReaction.C.

dkfdT()

Foam::scalar dkfdT ( const scalar  p, const scalar  T, const scalarField &  c  ) const

virtual

Temperature derivative of forward rate.

Definition at line 166 of file IrreversibleReaction.C.

Referenced by IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::~IrreversibleReaction().

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dkrdT()

Foam::scalar dkrdT ( const scalar  p, const scalar  T, const scalarField &  c, const scalar  dkfdT, const scalar  kr  ) const

virtual

Temperature derivative of reverse rate.

Returns 0

Definition at line 188 of file IrreversibleReaction.C.

Referenced by IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::~IrreversibleReaction().

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beta()

const Foam::List< Foam::Tuple2< Foam::label, Foam::scalar > > & beta ( ) const

virtual

Third-body efficiencies (beta = 1-alpha)

non-empty only for third-body reactions with enhanced molecularity (alpha != 1)

Definition at line 212 of file IrreversibleReaction.C.

Referenced by IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::~IrreversibleReaction().

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dcidc()

void dcidc ( const scalar  p, const scalar  T, const scalarField &  c, scalarField &  dcidc  ) const

virtual

Species concentration derivative of the pressure dependent term.

By default this value is 1 as it multiplies the third-body term

Definition at line 230 of file IrreversibleReaction.C.

References IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::dcidc().

Referenced by IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::dcidc(), and IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::~IrreversibleReaction().

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dcidT()

Foam::scalar dcidT ( const scalar  p, const scalar  T, const scalarField &  c  ) const

virtual

Temperature derivative of the pressure dependent term.

By default this value is 0 since ddT of molecularity is approx.0

Definition at line 253 of file IrreversibleReaction.C.

References IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::dcidT(), and IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::write().

Referenced by IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::dcidT(), and IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::~IrreversibleReaction().

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write()

void write ( Ostream &  os ) const

virtual

Write.

Definition at line 271 of file IrreversibleReaction.C.

References Foam::blockMeshTools::write().

Referenced by IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::dcidT(), and IrreversibleReaction< ReactionType, ReactionThermo, ReactionRate >::~IrreversibleReaction().

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

• src/thermophysicalModels/specie/reaction/Reactions/IrreversibleReaction/IrreversibleReaction.H
• src/thermophysicalModels/specie/reaction/Reactions/IrreversibleReaction/IrreversibleReaction.C