N2.hpp

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// -*- mode: C++; tab-width: 4; indent-tabs-mode: nil; c-basic-offset: 4 -*-
// vi: set et ts=4 sw=4 sts=4:
/*
  This file is part of the Open Porous Media project (OPM).

  OPM is free software: you can redistribute it and/or modify
  it under the terms of the GNU General Public License as published by
  the Free Software Foundation, either version 2 of the License, or
  (at your option) any later version.

  OPM is distributed in the hope that it will be useful,
  but WITHOUT ANY WARRANTY; without even the implied warranty of
  MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
  GNU General Public License for more details.

  You should have received a copy of the GNU General Public License
  along with OPM.  If not, see <http://www.gnu.org/licenses/>.

  Consult the COPYING file in the top-level source directory of this
  module for the precise wording of the license and the list of
  copyright holders.
*/
#ifndef OPM_N2_HPP
#define OPM_N2_HPP

#include "Component.hpp"

#include <opm/material/IdealGas.hpp>
#include <opm/material/common/MathToolbox.hpp>

#include <cmath>
#include <string_view>

namespace Opm
{

template <class Scalar>
class N2 : public Component<Scalar, N2<Scalar> >
{
    typedef ::Opm::IdealGas<Scalar> IdealGas;

public:
    static std::string_view name()
    { return "N2"; }

    static Scalar molarMass()
    { return 28.0134e-3;}

    static Scalar criticalTemperature()
    { return 126.192; /* [K] */ }

    static Scalar criticalPressure()
    { return 3.39858e6; /* [N/m^2] */ }

    static Scalar criticalVolume() {return 8.94e-2; }

    static Scalar acentricFactor() { return 0.039; }

    static Scalar tripleTemperature()
    { return 63.151; /* [K] */ }

    static Scalar triplePressure()
    { return 12.523e3; /* [N/m^2] */ }

    template <class Evaluation>
    static Evaluation vaporPressure(const Evaluation& temperature)
    {
        if (temperature > criticalTemperature())
            return criticalPressure();
        if (temperature < tripleTemperature())
            return 0; // N2 is solid: We don't take sublimation into
                      // account

        // note: this is the ancillary equation given on page 1368
        const Evaluation& sigma = 1.0 - temperature/criticalTemperature();
        const Evaluation& sqrtSigma = sqrt(sigma);
        const Scalar N1 = -6.12445284;
        const Scalar N2 = 1.26327220;
        const Scalar N3 = -0.765910082;
        const Scalar N4 = -1.77570564;
        return
            criticalPressure() *
            exp(criticalTemperature()/temperature*
                         (sigma*(N1 +
                                 sqrtSigma*N2 +
                                 sigma*(sqrtSigma*N3 +
                                        sigma*sigma*sigma*N4))));
    }

    template <class Evaluation>
    static Evaluation gasDensity(const Evaluation& temperature, const Evaluation& pressure)
    {
        // Assume an ideal gas
        return IdealGas::density(Evaluation(molarMass()), temperature, pressure);
    }

    static bool gasIsCompressible()
    { return true; }

    static bool gasIsIdeal()
    { return true; }

    template <class Evaluation>
    static Evaluation gasPressure(const Evaluation& temperature, const Evaluation& density)
    {
        // Assume an ideal gas
        return IdealGas::pressure(temperature, density/molarMass());
    }

    template <class Evaluation>
    static Evaluation gasEnthalpy(const Evaluation& temperature,
                                  const Evaluation&)
    {
        // method of Joback
        const Scalar cpVapA = 31.15;
        const Scalar cpVapB = -0.01357;
        const Scalar cpVapC = 2.680e-5;
        const Scalar cpVapD = -1.168e-8;

        // calculate: \int_0^T c_p dT
        return
            1/molarMass()* // conversion from [J/(mol K)] to [J/(kg K)]

            temperature*(cpVapA + temperature*
                         (cpVapB/2 + temperature*
                          (cpVapC/3 + temperature*
                           (cpVapD/4))));
    }

    template <class Evaluation>
    static Evaluation gasInternalEnergy(const Evaluation& temperature,
                                        const Evaluation& pressure)
    {
        return
            gasEnthalpy(temperature, pressure) -
            1/molarMass()* // conversion from [J/(mol K)] to [J/(kg K)]
            IdealGas::R*temperature; // = pressure * spec. volume for an ideal gas
    }

    template <class Evaluation>
    static Evaluation gasHeatCapacity(const Evaluation& temperature,
                                      const Evaluation&)
    {
        // method of Joback
        const Scalar cpVapA = 31.15;
        const Scalar cpVapB = -0.01357;
        const Scalar cpVapC = 2.680e-5;
        const Scalar cpVapD = -1.168e-8;

        return
            1/molarMass()* // conversion from [J/(mol K)] to [J/(kg K)]

            cpVapA + temperature*
            (cpVapB + temperature*
             (cpVapC + temperature*
              (cpVapD)));
    }
    template <class Evaluation>
    static Evaluation gasViscosity(const Evaluation& temperature, const Evaluation& /*pressure*/)
    {
        const Scalar Tc = criticalTemperature();
        const Scalar Vc = 90.1; // critical specific volume [cm^3/mol]
        const Scalar omega = 0.037; // accentric factor
        const Scalar M = molarMass() * 1e3; // molar mas [g/mol]
        const Scalar dipole = 0.0; // dipole moment [debye]

        Scalar mu_r4 = 131.3 * dipole / std::sqrt(Vc * Tc);
        mu_r4 *= mu_r4;
        mu_r4 *= mu_r4;

        Scalar Fc = 1 - 0.2756*omega + 0.059035*mu_r4;
        const Evaluation& Tstar = 1.2593 * temperature/Tc;
        const Evaluation& Omega_v =
            1.16145*pow(Tstar, -0.14874) +
            0.52487*exp(- 0.77320*Tstar) +
            2.16178*exp(- 2.43787*Tstar);
        const Evaluation& mu = 40.785*Fc*sqrt(M*temperature)/(std::pow(Vc, 2./3)*Omega_v);

        // convertion from micro poise to Pa s
        return mu/1e6 / 10;
    }

    template <class Evaluation>
    static Evaluation gasThermalConductivity(const Evaluation& /*temperature*/,
                                             const Evaluation& /*pressure*/)
    { return 0.024572; }
};

} // namespace Opm

#endif