/** * * @file ConstDensityThermo.cpp * */ #ifdef WIN32 #pragma warning(disable:4786) #pragma warning(disable:4503) #endif #include "ct_defs.h" #include "mix_defs.h" #include "ConstDensityThermo.h" #include "SpeciesThermo.h" namespace Cantera { int ConstDensityThermo:: eosType() const { return cIncompressible; } doublereal ConstDensityThermo::enthalpy_mole() const { doublereal p0 = m_spthermo->refPressure(); return GasConstant * temperature() * mean_X(&enthalpy_RT()[0]) + (pressure() - p0)/molarDensity(); } doublereal ConstDensityThermo::intEnergy_mole() const { doublereal p0 = m_spthermo->refPressure(); return GasConstant * temperature() * mean_X(&enthalpy_RT()[0]) - p0/molarDensity(); } doublereal ConstDensityThermo::entropy_mole() const { return GasConstant * (mean_X(&entropy_R()[0]) - sum_xlogx()); } doublereal ConstDensityThermo::gibbs_mole() const { return enthalpy_mole() - temperature() * entropy_mole(); } doublereal ConstDensityThermo::cp_mole() const { return GasConstant * mean_X(&cp_R()[0]); } doublereal ConstDensityThermo::cv_mole() const { return cp_mole(); } doublereal ConstDensityThermo::pressure() const { return m_press; } void ConstDensityThermo::setPressure(doublereal p) { m_press = p; } void ConstDensityThermo::getActivityConcentrations(doublereal* c) const { getConcentrations(c); } void ConstDensityThermo::getActivityCoefficients(doublereal* ac) const { for (int k = 0; k < m_kk; k++) { ac[k] = 1.0; } } doublereal ConstDensityThermo::standardConcentration(int k) const { return molarDensity(); } doublereal ConstDensityThermo::logStandardConc(int k) const { return log(molarDensity()); } void ConstDensityThermo::getChemPotentials(doublereal* mu) const { doublereal vdp = (pressure() - m_spthermo->refPressure())/ molarDensity(); doublereal xx; doublereal rt = temperature() * GasConstant; const array_fp& g_RT = gibbs_RT(); for (int k = 0; k < m_kk; k++) { xx = fmaxx(SmallNumber, moleFraction(k)); mu[k] = rt*(g_RT[k] + log(xx)) + vdp; } } void ConstDensityThermo::getStandardChemPotentials(doublereal* mu0) const { getPureGibbs(mu0); } void ConstDensityThermo::initThermo() { m_kk = nSpecies(); m_mm = nElements(); doublereal tmin = m_spthermo->minTemp(); doublereal tmax = m_spthermo->maxTemp(); if (tmin > 0.0) m_tmin = tmin; if (tmax > 0.0) m_tmax = tmax; m_p0 = refPressure(); int leng = m_kk; m_h0_RT.resize(leng); m_g0_RT.resize(leng); m_expg0_RT.resize(leng); m_cp0_R.resize(leng); m_s0_R.resize(leng); m_pe.resize(leng, 0.0); m_pp.resize(leng); } void ConstDensityThermo::setToEquilState(const doublereal* lambda_RT) { throw CanteraError("setToEquilState","not yet impl."); } void ConstDensityThermo::_updateThermo() const { doublereal tnow = temperature(); if (m_tlast != tnow) { m_spthermo->update(tnow, &m_cp0_R[0], &m_h0_RT[0], &m_s0_R[0]); m_tlast = tnow; int k; for (k = 0; k < m_kk; k++) { m_g0_RT[k] = m_h0_RT[k] - m_s0_R[k]; } m_tlast = tnow; } } void ConstDensityThermo::setParametersFromXML(const XML_Node& eosdata) { eosdata._require("model","Incompressible"); doublereal rho = getFloat(eosdata, "density", "-"); setDensity(rho); } }