diff --git a/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGas.C b/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGas.C index e2b99d08a7a6e258bc8bd228af320e852116b23f..c3fefab779606e5335f5c29c157ddd0207566978 100644 --- a/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGas.C +++ b/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGas.C @@ -33,6 +33,8 @@ Foam::PengRobinsonGas<Specie>::PengRobinsonGas(Istream& is) : Specie(is), Tc_(readScalar(is)), + Vc_(readScalar(is)), + Zc_(readScalar(is)), Pc_(readScalar(is)), omega_(readScalar(is)) { @@ -48,9 +50,13 @@ Foam::PengRobinsonGas<Specie>::PengRobinsonGas : Specie(dict), Tc_(readScalar(dict.subDict("equationOfState").lookup("Tc"))), + Vc_(readScalar(dict.subDict("equationOfState").lookup("Vc"))), + Zc_(1.0), Pc_(readScalar(dict.subDict("equationOfState").lookup("Pc"))), omega_(readScalar(dict.subDict("equationOfState").lookup("omega"))) -{} +{ + Zc_ = Pc_*Vc_/(specie::RR*Tc_); +} // * * * * * * * * * * * * * * * Member Functions * * * * * * * * * * * * * // @@ -74,6 +80,8 @@ Foam::Ostream& Foam::operator<< { os << static_cast<const Specie&>(pg) << token::SPACE << pg.Tc_ + << token::SPACE << pg.Vc_ + << token::SPACE << pg.Zc_ << token::SPACE << pg.Pc_ << token::SPACE << pg.omega_; diff --git a/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGas.H b/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGas.H index 7d1df1124530fac6cfd709ab7dabc025a66e5cf0..568b35a3c55c107ab1d3ba13501fd8c9e5de2d88 100644 --- a/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGas.H +++ b/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGas.H @@ -98,10 +98,16 @@ class PengRobinsonGas //- Critical Temperature [K] scalar Tc_; + //- Critical volume [m^3/kmol] + scalar Vc_; + + //- Critical compression factor [-] + scalar Zc_; + //- Critical Pressure [Pa] scalar Pc_; - //- Accentric factor [-] + //- Acentric factor [-] scalar omega_; @@ -114,6 +120,8 @@ public: ( const Specie& sp, const scalar& Tc, + const scalar& Vc, + const scalar& Zc, const scalar& Pc, const scalar& omega ); @@ -163,7 +171,7 @@ public: //- Return compressibility rho/p [s^2/m^2] inline scalar psi(scalar p, scalar T) const; - //- Return compression factor [] + //- Return compression factor [-] inline scalar Z(scalar p, scalar T) const; //- Return (cp - cv) [J/(kmol K] diff --git a/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGasI.H b/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGasI.H index aae0b92fcb0146cb2a113c05a2bc60d8ee93d791..d5b0c47594d87c36c00ed98d9d992888f6d31ba0 100644 --- a/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGasI.H +++ b/src/thermophysicalModels/specie/equationOfState/PengRobinsonGas/PengRobinsonGasI.H @@ -21,7 +21,6 @@ License You should have received a copy of the GNU General Public License along with OpenFOAM. If not, see <http://www.gnu.org/licenses/>. - \*---------------------------------------------------------------------------*/ #include "PengRobinsonGas.H" @@ -34,12 +33,16 @@ inline Foam::PengRobinsonGas<Specie>::PengRobinsonGas ( const Specie& sp, const scalar& Tc, + const scalar& Vc, + const scalar& Zc, const scalar& Pc, const scalar& omega ) : Specie(sp), Tc_(Tc), + Vc_(Vc), + Zc_(Zc), Pc_(Pc), omega_(omega) {} @@ -55,9 +58,11 @@ inline Foam::PengRobinsonGas<Specie>::PengRobinsonGas ) : Specie(name, pg), - Tc_(pg.Tc), - Pc_(pg.Pc), - omega_(pg.omega) + Tc_(pg.Tc_), + Pc_(pg.Pc_), + Vc_(pg.Vc_), + Zc_(pg.Zc_), + omega_(pg.omega_) {} @@ -96,6 +101,7 @@ Foam::PengRobinsonGas<Specie>::New ); } + // * * * * * * * * * * * * * * * Member Functions * * * * * * * * * * * * * // template<class Specie> @@ -214,7 +220,9 @@ inline void Foam::PengRobinsonGas<Specie>::operator+= scalar molr2 = pg.nMoles()/this->nMoles(); Tc_ = molr1*Tc_ + molr2*pg.Tc_; - Pc_ = molr1*Pc_ + molr2*pg.Pc_; + Vc_ = molr1*Vc_ + molr2*pg.Vc_; + Zc_ = molr1*Zc_ + molr2*pg.Zc_; + Pc_ = specie::RR*Zc_*Tc_/Vc_; omega_ = molr1*omega_ + molr2*pg.omega_; } @@ -233,7 +241,9 @@ inline void Foam::PengRobinsonGas<Specie>::operator-= scalar molr2 = pg.nMoles()/this->nMoles(); Tc_ = molr1*Tc_ - molr2*pg.Tc_; - Pc_ = molr1*Pc_ - molr2*pg.Pc_; + Vc_ = molr1*Vc_ - molr2*pg.Vc_; + Zc_ = molr1*Zc_ - molr2*pg.Zc_; + Pc_ = specie::RR*Zc_*Tc_/Vc_; omega_ = molr1*omega_ - molr2*pg.omega_; } @@ -259,12 +269,18 @@ Foam::PengRobinsonGas<Specie> Foam::operator+ scalar molr1 = pg1.nMoles()/nMoles; scalar molr2 = pg2.nMoles()/nMoles; + const scalar Tc = molr1*pg1.Tc_ + molr2*pg2.Tc_; + const scalar Vc = molr1*pg1.Vc_ + molr2*pg2.Vc_; + const scalar Zc = molr1*pg1.Zc_ + molr2*pg2.Zc_; + return PengRobinsonGas<Specie> ( static_cast<const Specie&>(pg1) + static_cast<const Specie&>(pg2), - molr1*pg1.Tc_ + molr2*pg2.Tc_, - molr1*pg1.Pc_ + molr2*pg2.Pc_, + Tc, + Vc, + Zc, + specie::RR*Zc*Tc/Vc, molr1*pg1.omega_ + molr2*pg2.omega_ ); } @@ -281,12 +297,18 @@ Foam::PengRobinsonGas<Specie> Foam::operator- scalar molr1 = pg1.nMoles()/nMoles; scalar molr2 = pg2.nMoles()/nMoles; + const scalar Tc = molr1*pg1.Tc_ + molr2*pg2.Tc_; + const scalar Vc = molr1*pg1.Vc_ + molr2*pg2.Vc_; + const scalar Zc = molr1*pg1.Zc_ + molr2*pg2.Zc_; + return PengRobinsonGas<Specie> ( static_cast<const Specie&>(pg1) - static_cast<const Specie&>(pg2), - molr1*pg1.Tc_ - molr2*pg2.Tc_, - molr1*pg1.Pc_ - molr2*pg2.Pc_, + Tc, + Vc, + Zc, + specie::RR*Zc*Tc/Vc, molr1*pg1.omega_ - molr2*pg2.omega_ ); } @@ -303,6 +325,8 @@ Foam::PengRobinsonGas<Specie> Foam::operator* ( s*static_cast<const Specie&>(pg), pg.Tc_, + pg.Vc_, + pg.Zc_, pg.Pc_, pg.omega_ );