cantera/src/tpx/RedlichKwong.cpp

73 lines
1.5 KiB
C++

#include "RedlichKwong.h"
#include <math.h>
namespace tpx
{
double RedlichKwong::up()
{
return -Pp()/Rho + hresid() + m_energy_offset;
}
double RedlichKwong::hresid()
{
double hh = m_b * (Rho/m_mw);
double hresid_mol_RT = z() - 1.0
- (1.5*m_a/(m_b*8314.3*T*sqrt(T)))*log(1.0 + hh);
return 8314.3*T*hresid_mol_RT/m_mw;
}
double RedlichKwong::sresid()
{
double hh = m_b * (Rho/m_mw);
double sresid_mol_R = log(z()*(1.0 - hh))
- (0.5*m_a/(m_b*8314.3*T*sqrt(T)))*log(1.0 + hh);
return 8314.3*sresid_mol_R/m_mw;
}
double RedlichKwong::sp()
{
const double Pref = 101325.0;
double rgas = 8314.3/m_mw;
//double ss = rgas*(log(Pref/(Rho*rgas*T)));
double sr = sresid();
double p = Pp();
return rgas*(log(Pref/p)) + sr + m_entropy_offset;
}
double RedlichKwong::z()
{
return Pp()*m_mw/(Rho*8314.3*T);
}
double RedlichKwong::Pp()
{
double R = 8314.3;
double V = m_mw/Rho;
return R*T/(V - m_b) - m_a/(sqrt(T)*V*(V+m_b));
}
double RedlichKwong::Psat()
{
double tt = m_tcrit/T;
double lpr = -0.8734*tt*tt - 3.4522*tt + 4.2918;
return m_pcrit*exp(lpr);
}
double RedlichKwong::ldens()
{
double c;
int i;
double sqt = sqrt(T);
double v = m_b, vnew;
double pp = Psat();
double Rhsave = Rho;
for (i = 0; i < 50; i++) {
c = m_b*m_b + m_b*GasConstant*T/pp - m_a/(pp*sqt);
vnew = (1.0/c)*(v*v*v - GasConstant*T*v*v/pp - m_a*m_b/(pp*sqt));
v = vnew;
}
Rho = Rhsave;
return m_mw/vnew;
}
}