ReversibleReaction.C

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#include "ReversibleReaction.H"

// * * * * * * * * * * * * * * * * Constructors  * * * * * * * * * * * * * * //

template<class ReactionThermo, class ReactionRate>
Foam::ReversibleReaction<ReactionThermo, ReactionRate>::
ReversibleReaction
(
    const Reaction<ReactionThermo>& reaction,
    const ReactionRate& k
)
:
    Reaction<ReactionThermo>(reaction),
    k_(k)
{}


template<class ReactionThermo, class ReactionRate>
Foam::ReversibleReaction<ReactionThermo, ReactionRate>::
ReversibleReaction
(
    const speciesTable& species,
    const HashPtrTable<ReactionThermo>& thermoDatabase,
    const dictionary& dict
)
:
    Reaction<ReactionThermo>(species, thermoDatabase, dict),
    k_(species, dict)
{}


template<class ReactionThermo, class ReactionRate>
Foam::ReversibleReaction<ReactionThermo, ReactionRate>::
ReversibleReaction
(
    const speciesTable& species,
    const HashPtrTable<ReactionThermo>& thermoDatabase,
    const objectRegistry& ob,
    const dictionary& dict
)
:
    Reaction<ReactionThermo>(species, thermoDatabase, dict),
    k_(species, ob, dict)
{}


template<class ReactionThermo, class ReactionRate>
Foam::ReversibleReaction<ReactionThermo, ReactionRate>::
ReversibleReaction
(
    const ReversibleReaction<ReactionThermo, ReactionRate>& rr,
    const speciesTable& species
)
:
    Reaction<ReactionThermo>(rr, species),
    k_(rr.k_)
{}


// * * * * * * * * * * * * * * * Member Functions  * * * * * * * * * * * * * //

template<class ReactionThermo, class ReactionRate>
void
Foam::ReversibleReaction<ReactionThermo, ReactionRate>::preEvaluate() const
{
    k_.preEvaluate();
}


template<class ReactionThermo, class ReactionRate>
void
Foam::ReversibleReaction<ReactionThermo, ReactionRate>::postEvaluate() const
{
    k_.postEvaluate();
}


template<class ReactionThermo, class ReactionRate>
Foam::scalar Foam::ReversibleReaction<ReactionThermo, ReactionRate>::kf
(
    const scalar p,
    const scalar T,
    const scalarField& c,
    const label li
) const
{
    return k_(p, T, c, li);
}


template<class ReactionThermo, class ReactionRate>
Foam::scalar Foam::ReversibleReaction<ReactionThermo, ReactionRate>::kr
(
    const scalar kfwd,
    const scalar p,
    const scalar T,
    const scalarField& c,
    const label li
) const
{
    return kfwd/max(this->Kc(p, T), rootSmall);
}


template<class ReactionThermo, class ReactionRate>
Foam::scalar Foam::ReversibleReaction<ReactionThermo, ReactionRate>::kr
(
    const scalar p,
    const scalar T,
    const scalarField& c,
    const label li
) const
{
    return kr(kf(p, T, c, li), p, T, c, li);
}


template<class ReactionThermo, class ReactionRate>
Foam::scalar Foam::ReversibleReaction<ReactionThermo, ReactionRate>::dkfdT
(
    const scalar p,
    const scalar T,
    const scalarField& c,
    const label li
) const
{
    return k_.ddT(p, T, c, li);
}


template<class ReactionThermo, class ReactionRate>
Foam::scalar Foam::ReversibleReaction<ReactionThermo, ReactionRate>::dkrdT
(
    const scalar p,
    const scalar T,
    const scalarField& c,
    const label li,
    const scalar dkfdT,
    const scalar kr
) const
{
    const scalar Kc = max(this->Kc(p, T), rootSmall);

    return dkfdT/Kc - (Kc > rootSmall ? kr*this->dKcdTbyKc(p, T) : 0);
}


template<class ReactionThermo, class ReactionRate>
bool Foam::ReversibleReaction<ReactionThermo, ReactionRate>::hasDkdc() const
{
    return k_.hasDdc();
}


template<class ReactionThermo, class ReactionRate>
void Foam::ReversibleReaction<ReactionThermo, ReactionRate>::dkfdc
(
    const scalar p,
    const scalar T,
    const scalarField& c,
    const label li,
    scalarField& dkfdc
) const
{
    k_.ddc(p, T, c, li, dkfdc);
}


template<class ReactionThermo, class ReactionRate>
void Foam::ReversibleReaction<ReactionThermo, ReactionRate>::dkrdc
(
    const scalar p,
    const scalar T,
    const scalarField& c,
    const label li,
    const scalarField& dkfdc,
    const scalar kr,
    scalarField& dkrdc
) const
{
    const scalar Kc = max(this->Kc(p, T), rootSmall);

    dkrdc = dkfdc/Kc;
}


template<class ReactionThermo, class ReactionRate>
void Foam::ReversibleReaction<ReactionThermo, ReactionRate>::write
(
    Ostream& os
) const
{
    Reaction<ReactionThermo>::write(os);
    k_.write(os);
}


// ************************************************************************* //