cantera/test/thermo/thermoParameterizations.cpp
2014-10-17 23:44:31 +00:00

96 lines
4.2 KiB
C++

#include "gtest/gtest.h"
#include "cantera/thermo/speciesThermoTypes.h"
#include "cantera/thermo/SimpleThermo.h"
#include "cantera/thermo/IdealGasPhase.h"
#include "cantera/thermo/ConstCpPoly.h"
#include "cantera/thermo/GeneralSpeciesThermo.h"
#include "cantera/thermo/NasaPoly2.h"
#include "cantera/thermo/ShomatePoly.h"
#include "thermo_data.h"
using namespace Cantera;
class SpeciesThermoInterpTypeTest : public testing::Test
{
public:
SpeciesThermoInterpTypeTest() {
p.addElement("H");
p.addElement("O");
p.addElement("C");
}
IdealGasPhase p;
};
// {T0, h0, s0, cp0} (in J/kmol)
double c_o2[] = {298.15, 0.0, 2.05152e5, 2.939e4};
double c_h2[] = {298.15, 0.0, 1.3068e5, 2.885e4};
double c_h2o[] = {298.15, -2.41826e8, 1.8884e5, 3.522e4};
double c_co2[] = {298.15, -3.9351e8, 2.13785e5, 3.712e4};
TEST_F(SpeciesThermoInterpTypeTest, install_const_cp)
{
// Compare against instantiation from CTI file
IdealGasPhase p2("../data/simplephases.cti", "simple1");
SpeciesThermoInterpType* stit_o2 = new ConstCpPoly(0, 200, 5000, 101325, c_o2);
SpeciesThermoInterpType* stit_h2 = new ConstCpPoly(1, 200, 5000, 101325, c_h2);
SpeciesThermoInterpType* stit_h2o = new ConstCpPoly(2, 200, 5000, 101325, c_h2o);
p.addSpecies(Species("O2", parseCompString("O:2"), stit_o2));
p.addSpecies(Species("H2", parseCompString("H:2"), stit_h2));
p.addSpecies(Species("H2O", parseCompString("H:2 O:1"), stit_h2o));
p.initThermo();
p2.setState_TPX(298.15, 101325, "H2:0.2, O2:0.7, H2O:0.1");
p.setState_TPX(298.15, 101325, "H2:0.2, O2:0.7, H2O:0.1");
EXPECT_FLOAT_EQ(p2.meanMolecularWeight(), p.meanMolecularWeight());
EXPECT_FLOAT_EQ(p2.enthalpy_mass(), p.enthalpy_mass());
EXPECT_FLOAT_EQ(p2.entropy_mass(), p.entropy_mass());
EXPECT_FLOAT_EQ(p2.cp_mass(), p.cp_mass());
}
TEST_F(SpeciesThermoInterpTypeTest, DISABLED_install_bad_pref)
{
// Currently broken because GeneralSpeciesThermo does not enforce reference
// pressure consistency.
SpeciesThermoInterpType* stit_o2 = new ConstCpPoly(0, 200, 5000, 101325, c_o2);
SpeciesThermoInterpType* stit_h2 = new ConstCpPoly(1, 200, 5000, 100000, c_h2);
p.addSpecies(Species("O2", parseCompString("O:2"), stit_o2));
// Pref does not match
ASSERT_THROW(p.addSpecies(Species("H2", parseCompString("H:2"), stit_h2)), CanteraError);
delete stit_h2;
}
TEST_F(SpeciesThermoInterpTypeTest, install_nasa)
{
// Compare against instantiation from CTI file
IdealGasPhase p2("../data/simplephases.cti", "nasa1");
SpeciesThermoInterpType* stit_o2 = new NasaPoly2(0, 200, 3500, 101325, o2_nasa_coeffs);
SpeciesThermoInterpType* stit_h2 = new NasaPoly2(1, 200, 3500, 101325, h2_nasa_coeffs);
SpeciesThermoInterpType* stit_h2o = new NasaPoly2(2, 200, 3500, 101325, h2o_nasa_coeffs);
p.addSpecies(Species("O2", parseCompString("O:2"), stit_o2));
p.addSpecies(Species("H2", parseCompString("H:2"), stit_h2));
p.addSpecies(Species("H2O", parseCompString("H:2 O:1"), stit_h2o));
p.initThermo();
p2.setState_TPX(900, 101325, "H2:0.2, O2:0.7, H2O:0.1");
p.setState_TPX(900, 101325, "H2:0.2, O2:0.7, H2O:0.1");
EXPECT_FLOAT_EQ(p2.meanMolecularWeight(), p.meanMolecularWeight());
EXPECT_FLOAT_EQ(p2.enthalpy_mass(), p.enthalpy_mass());
EXPECT_FLOAT_EQ(p2.entropy_mass(), p.entropy_mass());
EXPECT_FLOAT_EQ(p2.cp_mass(), p.cp_mass());
}
TEST_F(SpeciesThermoInterpTypeTest, install_shomate)
{
// Compare against instantiation from CTI file
IdealGasPhase p2("../data/simplephases.cti", "shomate1");
SpeciesThermoInterpType* stit_co = new ShomatePoly2(0, 200, 6000, 101325, co_shomate_coeffs);
SpeciesThermoInterpType* stit_co2 = new ShomatePoly2(1, 200, 6000, 101325, co2_shomate_coeffs);
p.addSpecies(Species("CO", parseCompString("C:1 O:1"), stit_co));
p.addSpecies(Species("CO2", parseCompString("C:1 O:2"), stit_co2));
p.initThermo();
p2.setState_TPX(900, 101325, "CO:0.2, CO2:0.8");
p.setState_TPX(900, 101325, "CO:0.2, CO2:0.8");
EXPECT_FLOAT_EQ(p2.meanMolecularWeight(), p.meanMolecularWeight());
EXPECT_FLOAT_EQ(p2.enthalpy_mass(), p.enthalpy_mass());
EXPECT_FLOAT_EQ(p2.entropy_mass(), p.entropy_mass());
EXPECT_FLOAT_EQ(p2.cp_mass(), p.cp_mass());
}