Cantera  2.0
VPSSMgr_Water_ConstVol Class Reference

Virtual base class for the species thermo manager classes. More...

#include <VPSSMgr_Water_ConstVol.h>

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## Public Member Functions

VPSSMgr_Water_ConstVol (VPStandardStateTP *vp_ptr, SpeciesThermo *sp_ptr)
Base Constructor.

virtual ~VPSSMgr_Water_ConstVol ()
Destructor.

VPSSMgr_Water_ConstVol (const VPSSMgr_Water_ConstVol &right)
Copy Constructor for the SpeciesThermo object.

VPSSMgr_Water_ConstVoloperator= (const VPSSMgr_Water_ConstVol &right)
Assignment operator for the SpeciesThermo object.

virtual VPSSMgrduplMyselfAsVPSSMgr () const
Duplication routine for objects which inherit from VPSSSpeciesThermo.

Thermodynamic Values for the Species Reference States (VPStandardStateTP)
virtual void getEnthalpy_RT_ref (doublereal *hrt) const

virtual void getGibbs_RT_ref (doublereal *grt) const

virtual void getGibbs_ref (doublereal *g) const

virtual void getEntropy_R_ref (doublereal *er) const

virtual void getCp_R_ref (doublereal *cpr) const

virtual void getStandardVolumes_ref (doublereal *vol) const
Get the molar volumes of the species reference states at the current T and P_ref of the solution.

Properties of the Standard State of the Species in the Solution
virtual void getStandardChemPotentials (doublereal *mu) const
Get the array of chemical potentials at unit activity.

virtual void getGibbs_RT (doublereal *grt) const
Get the nondimensional Gibbs functions for the species at their standard states of solution at the current T and P of the solution.

virtual void getEnthalpy_RT (doublereal *hrt) const
Get the nondimensional Enthalpy functions for the species at their standard states at the current T and P of the solution.

const vector_fpenthalpy_RT () const
Return a reference to a vector of the molar enthalpies of the species in their standard states.

virtual void getEntropy_R (doublereal *sr) const
Get the array of nondimensional Enthalpy functions for the standard state species at the current T and P of the solution.

const vector_fpentropy_R () const
Return a reference to a vector of the entropies of the species.

virtual void getIntEnergy_RT (doublereal *urt) const
Returns the vector of nondimensional internal Energies of the standard state at the current temperature and pressure of the solution for each species.

virtual void getCp_R (doublereal *cpr) const
Get the nondimensional Heat Capacities at constant pressure for the standard state of the species at the current T and P.

const vector_fpcp_R () const
Return a reference to a vector of the constant pressure heat capacities of the species.

virtual void getStandardVolumes (doublereal *vol) const
Get the molar volumes of each species in their standard states at the current T and P of the solution.

const vector_fpstandardVolumes () const
Return a reference to a vector of the species standard molar volumes.

Thermodynamic Values for the Species Reference States (VPStandardStateTP)
const vector_fpGibbs_RT_ref () const
Return a reference to the vector of Gibbs free energies of the species.

Setting the Internal State of the System
virtual void setState_TP (doublereal T, doublereal P)
Set the temperature (K) and pressure (Pa)

virtual void setState_T (doublereal T)
Set the temperature (K)

virtual void setState_P (doublereal P)
Set the pressure (Pa)

doublereal temperature () const
Return the temperature stored in the object.

doublereal pressure () const
Return the pressure stored in the object.

SpeciesThermoSpeciesThermoMgr ()
Return the pointer to the reference-state Thermo calculator SpeciesThermo object.

Updates the internal standard state thermodynamic vectors at the current T and P of the solution.

virtual void updateRefStateThermo () const
Updates the internal reference state thermodynamic vectors at the current T of the solution and the reference pressure.

Utility Methods - Reports on various quantities
virtual doublereal minTemp (size_t k=npos) const
Minimum temperature.

virtual doublereal maxTemp (size_t k=npos) const
Maximum temperature.

virtual doublereal refPressure (size_t k=npos) const
The reference-state pressure for the standard state.

## Private Member Functions

Properties of the Standard State of the Species in the Solution

Within VPStandardStateTP, these properties are calculated via a common routine, _updateStandardStateThermo(), which must be overloaded in inherited objects. The values are cached within this object, and are not recalculated unless the temperature or pressure changes.

Updates the standard state thermodynamic functions at the current T and P of the solution.

virtual void _updateRefStateThermo () const
Updates the reference state thermodynamic functions at the current T of the solution and the reference pressure.

## Initialization Methods - For Internal use (VPStandardState)

void initLengths ()
Initialize the lengths within the object.

void installSTSpecies (size_t k, const XML_Node &speciesNode, const XML_Node *phaseNode_ptr)
Install specific content for species k in the reference-state thermodynamic SpeciesManager object.

size_t m_kk
Number of species in the phase.

VPStandardStateTPm_vptp_ptr
Variable pressure ThermoPhase object.

SpeciesThermom_spthermo
Pointer to reference state thermo calculator.

doublereal m_tlast
The last temperature at which the standard state thermodynamic properties were calculated at.

doublereal m_plast
The last pressure at which the Standard State thermodynamic properties were calculated at.

doublereal m_p0

doublereal m_minTemp
minimum temperature for the standard state calculations

doublereal m_maxTemp
maximum temperature for the standard state calculations

bool m_useTmpRefStateStorage

vector_fp m_h0_RT

vector_fp m_cp0_R
Vector containing the species reference constant pressure heat capacities at T = m_tlast and P = p_ref.

vector_fp m_g0_RT
Vector containing the species reference Gibbs functions at T = m_tlast and P = p_ref.

vector_fp m_s0_R
Vector containing the species reference entropies at T = m_tlast and P = p_ref.

vector_fp m_V0
Vector containing the species reference molar volumes.

bool m_useTmpStandardStateStorage

vector_fp m_hss_RT
Vector containing the species Standard State enthalpies at T = m_tlast and P = m_plast.

vector_fp m_cpss_R
Vector containing the species Standard State constant pressure heat capacities at T = m_tlast and P = m_plast.

vector_fp m_gss_RT
Vector containing the species Standard State Gibbs functions at T = m_tlast and P = m_plast.

vector_fp m_sss_R
Vector containing the species Standard State entropies at T = m_tlast and P = m_plast.

vector_fp m_Vss
Vector containing the species standard state volumes at T = m_tlast and P = m_plast.

vector_fp mPDSS_h0_RT
species reference enthalpies - used by individual PDSS objects

vector_fp mPDSS_cp0_R
species reference heat capacities - used by individual PDSS objects

vector_fp mPDSS_g0_RT
species reference gibbs free energies - used by individual PDSS objects

vector_fp mPDSS_s0_R
species reference entropies - used by individual PDSS objects

vector_fp mPDSS_V0
species reference state molar Volumes - used by individual PDSS objects

vector_fp mPDSS_hss_RT
species standard state enthalpies - used by individual PDSS objects

vector_fp mPDSS_cpss_R
species standard state heat capacities - used by individual PDSS objects

vector_fp mPDSS_gss_RT
species standard state gibbs free energies - used by individual PDSS objects

vector_fp mPDSS_sss_R
species standard state entropies - used by individual PDSS objects

vector_fp mPDSS_Vss
species standard state molar Volumes - used by individual PDSS objects

## Initialization Methods - For Internal use (VPStandardState)

Pointer to the Water PDSS object.

virtual void initThermo ()
Initialize the thermo, after all species have been entered.

virtual void initThermoXML (XML_Node &phaseNode, std::string id)
Finalize the thermo after all species have been entered.

virtual PDSScreateInstallPDSS (size_t k, const XML_Node &speciesNode, const XML_Node *const phaseNode_ptr)
Install specific content for species k in the standard-state thermodynamic calculator and also create/return a PDSS object for that species.

virtual PDSS_enumType reportPDSSType (int index=-1) const
This utility function reports the type of parameterization used for the species with index number index.

virtual VPSSMgr_enumType reportVPSSMgrType () const
This utility function reports the type of manager for the calculation of ss properties.

virtual void initAllPtrs (VPStandardStateTP *vp_ptr, SpeciesThermo *sp_ptr)
Initialize all internal pointers.

## Detailed Description

Virtual base class for the species thermo manager classes.

This class defines the interface which all subclasses must implement.

Class VPSSSpeciesThermo is the base class for a family of classes that compute properties of a set of species in their reference state at a range of temperatures. Note, the pressure dependence of the reference state is not handled by this particular species standard state model.

Definition at line 42 of file VPSSMgr_Water_ConstVol.h.

## Constructor & Destructor Documentation

 VPSSMgr_Water_ConstVol ( VPStandardStateTP * vp_ptr, SpeciesThermo * sp_ptr )

Base Constructor.

Initialize the object.

Parameters
 vp_ptr Pointer to the VPStandardStateTP standard state sp_ptr Pointer to the SpeciesThermo standard state

Definition at line 27 of file VPSSMgr_Water_ConstVol.cpp.

Referenced by VPSSMgr_Water_ConstVol::duplMyselfAsVPSSMgr().

 ~VPSSMgr_Water_ConstVol ( )
virtual

Destructor.

Definition at line 37 of file VPSSMgr_Water_ConstVol.cpp.

 VPSSMgr_Water_ConstVol ( const VPSSMgr_Water_ConstVol & right )

Copy Constructor for the SpeciesThermo object.

Parameters
 right Reference to SpeciesThermo object to be copied into the current one.

Definition at line 41 of file VPSSMgr_Water_ConstVol.cpp.

## Member Function Documentation

 VPSSMgr_Water_ConstVol & operator= ( const VPSSMgr_Water_ConstVol & right )

Assignment operator for the SpeciesThermo object.

This is NOT a virtual function.

Parameters
 right Reference to SpeciesThermo object to be copied into the current one.

Definition at line 51 of file VPSSMgr_Water_ConstVol.cpp.

References VPSSMgr::operator=().

 VPSSMgr * duplMyselfAsVPSSMgr ( ) const
virtual

Duplication routine for objects which inherit from VPSSSpeciesThermo.

This virtual routine can be used to duplicate VPSSSpeciesThermo objects inherited from VPSSSpeciesThermo even if the application only has a pointer to VPSSSpeciesThermo to work with.

Reimplemented from VPSSMgr.

Definition at line 61 of file VPSSMgr_Water_ConstVol.cpp.

privatevirtual

Updates the standard state thermodynamic functions at the current T and P of the solution.

If m_useTmpStandardStateStorage is true, this function must be called for every call to functions in this class. It checks to see whether the temperature or pressure has changed and thus the ss thermodynamics functions for all of the species must be recalculated.

This function is responsible for updating the following internal members,

• m_hss_RT;
• m_cpss_R;
• m_gss_RT;
• m_sss_R;
• m_Vss

If m_useTmpStandardStateStorage is not true, this function may be required to be called by child classes to update internal member data.

Note, this will throw an error. It must be reimplemented in derived classes.

Reimplemented from VPSSMgr.

Definition at line 188 of file VPSSMgr_Water_ConstVol.cpp.

 void _updateRefStateThermo ( ) const
privatevirtual

Updates the reference state thermodynamic functions at the current T of the solution and the reference pressure.

Underscore updates never check for the state of the system. They just do the calculation.

This function is responsible for updating the following internal members

• m_h0_RT;
• m_cp0_R;
• m_g0_RT;
• m_s0_R;
• m_V0

This routine also updates all of the thermo to the current temperature

Reimplemented from VPSSMgr.

Definition at line 167 of file VPSSMgr_Water_ConstVol.cpp.

 void getEnthalpy_RT_ref ( doublereal * hrt ) const
virtual

There are also temporary variables for holding the species reference-state values of Cp, H, S, and V at the last temperature and reference pressure called. These functions are not recalculated if a new call is made using the previous temperature. All calculations are done within the routine _updateRefStateThermo().

Returns the vector of nondimensional enthalpies of the reference state at the current temperature of the solution and the reference pressure for the species.

Parameters
 hrt Output vector contains the nondimensional enthalpies of the reference state of the species length = m_kk, units = dimensionless.

Reimplemented from VPSSMgr.

Definition at line 81 of file VPSSMgr_Water_ConstVol.cpp.

 void getGibbs_RT_ref ( doublereal * grt ) const
virtual

Returns the vector of nondimensional Gibbs free energies of the reference state at the current temperature of the solution and the reference pressure for the species.

Parameters
 grt Output vector contains the nondimensional Gibbs free energies of the reference state of the species length = m_kk, units = dimensionless.

Reimplemented from VPSSMgr.

Definition at line 97 of file VPSSMgr_Water_ConstVol.cpp.

Referenced by VPSSMgr_Water_ConstVol::getGibbs_ref().

 void getGibbs_ref ( doublereal * g ) const
virtual

Returns the vector of the gibbs function of the reference state at the current temperature of the solution and the reference pressure for the species. units = J/kmol

Parameters
 g Output vector contain the Gibbs free energies of the reference state of the species length = m_kk, units = J/kmol.

Reimplemented from VPSSMgr.

Definition at line 113 of file VPSSMgr_Water_ConstVol.cpp.

 void getEntropy_R_ref ( doublereal * er ) const
virtual

Returns the vector of nondimensional entropies of the reference state at the current temperature of the solution and the reference pressure for the species.

Parameters
 er Output vector contain the nondimensional entropies of the species in their reference states length: m_kk, units: dimensionless.

Reimplemented from VPSSMgr.

Definition at line 123 of file VPSSMgr_Water_ConstVol.cpp.

 void getCp_R_ref ( doublereal * cpr ) const
virtual

Returns the vector of nondimensional constant pressure heat capacities of the reference state at the current temperature of the solution and reference pressure for the species.

Parameters
 cpr Output vector contains the nondimensional heat capacities of the species in their reference states length: m_kk, units: dimensionless.

Reimplemented from VPSSMgr.

Definition at line 138 of file VPSSMgr_Water_ConstVol.cpp.

 void getStandardVolumes_ref ( doublereal * vol ) const
virtual

Get the molar volumes of the species reference states at the current T and P_ref of the solution.

units = m^3 / kmol

Parameters
 vol Output vector containing the standard state volumes. Length: m_kk.

Reimplemented from VPSSMgr.

Definition at line 153 of file VPSSMgr_Water_ConstVol.cpp.

 void initThermo ( )
virtual

Initialize the thermo, after all species have been entered.

The following methods are used in the process of constructing the phase and setting its parameters from a specification in an input file. They are not normally used in application programs. To see how they are used, see files importCTML.cpp and ThermoFactory.cpp.

Initialize the object

This method is provided to allow subclasses to perform any initialization required after all species have been added. For example, it might be used to resize internal work arrays that must have an entry for each species. The base class implementation does nothing, and subclasses that do not require initialization do not need to overload this method. When importing a CTML phase description, this method is called just prior to returning from function importPhase().

importCTML.cpp

Reimplemented from VPSSMgr.

Definition at line 213 of file VPSSMgr_Water_ConstVol.cpp.

References VPSSMgr::initThermo().

 void initThermoXML ( XML_Node & phaseNode, std::string id )
virtual

Finalize the thermo after all species have been entered.

This function is the LAST initialization routine to be called. It's called after createInstallPDSS() has been called for each species in the phase, and after initThermo() has been called. It's called via an inner-to-outer onion shell like manner.

Parameters
 phaseNode Reference to the phaseNode XML node. id ID of the phase.

Reimplemented from VPSSMgr.

Definition at line 219 of file VPSSMgr_Water_ConstVol.cpp.

 PDSS * createInstallPDSS ( size_t k, const XML_Node & speciesNode, const XML_Node *const phaseNode_ptr )
virtual

Install specific content for species k in the standard-state thermodynamic calculator and also create/return a PDSS object for that species.

This occurs before matrices are sized appropriately.

Parameters
 k Species index in the phase speciesNode XML Node corresponding to the species phaseNode_ptr Pointer to the XML Node corresponding to the phase which owns the species

Reimplemented from VPSSMgr.

Definition at line 261 of file VPSSMgr_Water_ConstVol.cpp.

 PDSS_enumType reportPDSSType ( int index = -1 ) const
virtual

This utility function reports the type of parameterization used for the species with index number index.

Parameters
 index Species index

Reimplemented from VPSSMgr.

Definition at line 318 of file VPSSMgr_Water_ConstVol.cpp.

 VPSSMgr_enumType reportVPSSMgrType ( ) const
virtual

This utility function reports the type of manager for the calculation of ss properties.

Returns
Returns an enumerated type that is unique.

Reimplemented from VPSSMgr.

Definition at line 323 of file VPSSMgr_Water_ConstVol.cpp.

 void initAllPtrs ( VPStandardStateTP * vp_ptr, SpeciesThermo * sp_ptr )
virtual

Initialize all internal pointers.

This is a virtual function that fills or updates the values of the shallow pointers.

Parameters
 vp_ptr Pointer to the Variable Pressure standard state object sp_ptr Pointer to the reference state thermo calculator object

Reimplemented from VPSSMgr.

Definition at line 68 of file VPSSMgr_Water_ConstVol.cpp.

 void getStandardChemPotentials ( doublereal * mu ) const
virtualinherited

Get the array of chemical potentials at unit activity.

These are the standard state chemical potentials $$\mu^0_k(T,P)$$. The values are evaluated at the current temperature and pressure.

Parameters
 mu Output vector of standard state chemical potentials. length = m_kk. units are J / kmol.

Definition at line 158 of file VPSSMgr.cpp.

Referenced by VPStandardStateTP::getPureGibbs().

 void getGibbs_RT ( doublereal * grt ) const
virtualinherited

Get the nondimensional Gibbs functions for the species at their standard states of solution at the current T and P of the solution.

Parameters
 grt Output vector of nondimensional standard state Gibbs free energies. length = m_kk.

Definition at line 170 of file VPSSMgr.cpp.

References VPSSMgr::err(), VPSSMgr::m_gss_RT, and VPSSMgr::m_useTmpStandardStateStorage.

Referenced by VPStandardStateTP::getGibbs_RT().

 void getEnthalpy_RT ( doublereal * hrt ) const
virtualinherited

Get the nondimensional Enthalpy functions for the species at their standard states at the current T and P of the solution.

Parameters
 hrt Output vector of standard state enthalpies. length = m_kk. units are unitless.

Definition at line 180 of file VPSSMgr.cpp.

References VPSSMgr::err(), VPSSMgr::m_hss_RT, and VPSSMgr::m_useTmpStandardStateStorage.

Referenced by VPStandardStateTP::getEnthalpy_RT(), and VPSSMgr_IdealGas::getIntEnergy_RT().

 const vector_fp& enthalpy_RT ( ) const
inlineinherited

Return a reference to a vector of the molar enthalpies of the species in their standard states.

Definition at line 345 of file VPSSMgr.h.

References VPSSMgr::m_hss_RT.

Referenced by IdealSolnGasVPSS::enthalpy_mole().

 void getEntropy_R ( doublereal * sr ) const
virtualinherited

Get the array of nondimensional Enthalpy functions for the standard state species at the current T and P of the solution.

Parameters
 sr Output vector of nondimensional standard state entropies. length = m_kk.

Definition at line 190 of file VPSSMgr.cpp.

References VPSSMgr::err(), VPSSMgr::m_sss_R, and VPSSMgr::m_useTmpStandardStateStorage.

Referenced by VPStandardStateTP::getEntropy_R().

 const vector_fp& entropy_R ( ) const
inlineinherited

Return a reference to a vector of the entropies of the species.

Definition at line 361 of file VPSSMgr.h.

References VPSSMgr::m_sss_R.

Referenced by IdealSolnGasVPSS::entropy_mole().

 void getIntEnergy_RT ( doublereal * urt ) const
virtualinherited

Returns the vector of nondimensional internal Energies of the standard state at the current temperature and pressure of the solution for each species.

The internal energy is calculated from the enthalpy from the following formula:

$u^{ss}_k(T,P) = h^{ss}_k(T) - P * V^{ss}_k$

Parameters
 urt Output vector of nondimensional standard state internal energies. length = m_kk.

Reimplemented in VPSSMgr_IdealGas.

Definition at line 200 of file VPSSMgr.cpp.

Referenced by VPStandardStateTP::getIntEnergy_RT().

 void getCp_R ( doublereal * cpr ) const
virtualinherited

Get the nondimensional Heat Capacities at constant pressure for the standard state of the species at the current T and P.

This is redefined here to call the internal function, _updateStandardStateThermo(), which calculates all standard state properties at the same time.

Parameters
 cpr Output vector containing the the nondimensional Heat Capacities at constant pressure for the standard state of the species. Length: m_kk.

Definition at line 214 of file VPSSMgr.cpp.

References VPSSMgr::err(), VPSSMgr::m_cpss_R, and VPSSMgr::m_useTmpStandardStateStorage.

Referenced by VPStandardStateTP::getCp_R().

 const vector_fp& cp_R ( ) const
inlineinherited

Return a reference to a vector of the constant pressure heat capacities of the species.

Definition at line 398 of file VPSSMgr.h.

References VPSSMgr::m_cpss_R.

Referenced by IdealSolnGasVPSS::cp_mole().

 void getStandardVolumes ( doublereal * vol ) const
virtualinherited

Get the molar volumes of each species in their standard states at the current T and P of the solution.

units = m^3 / kmol

This is redefined here to call the internal function, _updateStandardStateThermo(), which calculates all standard state properties at the same time.

Parameters
 vol Output vector of species volumes. length = m_kk. units = m^3 / kmol

Reimplemented in VPSSMgr_IdealGas.

Definition at line 224 of file VPSSMgr.cpp.

References VPSSMgr::err(), VPSSMgr::m_useTmpStandardStateStorage, and VPSSMgr::m_Vss.

Referenced by VPStandardStateTP::getStandardVolumes(), and VPSSMgr::getStandardVolumes_ref().

 const vector_fp& standardVolumes ( ) const
inlineinherited

Return a reference to a vector of the species standard molar volumes.

Definition at line 418 of file VPSSMgr.h.

References VPSSMgr::m_Vss.

 const vector_fp& Gibbs_RT_ref ( ) const
inlineinherited

Return a reference to the vector of Gibbs free energies of the species.

Definition at line 460 of file VPSSMgr.h.

References VPSSMgr::m_g0_RT.

Referenced by IdealSolnGasVPSS::setToEquilState().

 void setState_TP ( doublereal T, doublereal P )
virtualinherited

Set the temperature (K) and pressure (Pa)

All calls to change the internal state of the system's T and P are done through these routines

These routine in turn call the following underlying virtual functions

An important point to note is that between calls the assumption that the underlying PDSS objects will retain their set Temperatures and Pressure CAN NOT BE MADE. For efficiency reasons, we may twiddle these to get derivatives.

This sets the temperature and pressure and triggers calculation of underlying quantities

Parameters
 T Temperature (K) P Pressure (Pa)

Reimplemented in VPSSMgr_Water_HKFT.

Definition at line 312 of file VPSSMgr.cpp.

 void setState_T ( doublereal T )
virtualinherited

Set the temperature (K)

Parameters
 T Temperature (K)

Reimplemented in VPSSMgr_Water_HKFT.

Definition at line 303 of file VPSSMgr.cpp.

 void setState_P ( doublereal P )
virtualinherited

Set the pressure (Pa)

Parameters
 P Pressure (Pa)

Reimplemented in VPSSMgr_Water_HKFT.

Definition at line 295 of file VPSSMgr.cpp.

 doublereal temperature ( ) const
inlineinherited

Return the temperature stored in the object.

Definition at line 553 of file VPSSMgr.h.

References VPSSMgr::m_tlast.

 doublereal pressure ( ) const
inlineinherited

Return the pressure stored in the object.

Definition at line 558 of file VPSSMgr.h.

References VPSSMgr::m_plast.

 SpeciesThermo* SpeciesThermoMgr ( )
inlineinherited

Return the pointer to the reference-state Thermo calculator SpeciesThermo object.

Definition at line 564 of file VPSSMgr.h.

References VPSSMgr::m_spthermo.

Referenced by Cantera::importPhase().

virtualinherited

Updates the internal standard state thermodynamic vectors at the current T and P of the solution.

If you are to peak internally inside the object, you need to call these functions after setState functions in order to be sure that the vectors are current.

Definition at line 325 of file VPSSMgr.cpp.

Referenced by VPSSMgr::setState_P(), VPSSMgr::setState_T(), and VPSSMgr::setState_TP().

 void updateRefStateThermo ( ) const
virtualinherited

Updates the internal reference state thermodynamic vectors at the current T of the solution and the reference pressure.

If you are to peak internally inside the object, you need to call these functions after setState functions in order to be sure that the vectors are current.

Reimplemented in VPSSMgr_Water_HKFT.

Definition at line 330 of file VPSSMgr.cpp.

References VPSSMgr::_updateRefStateThermo().

Referenced by VPSSMgr::setState_T(), and VPSSMgr::setState_TP().

 doublereal minTemp ( size_t k = npos ) const
virtualinherited

Minimum temperature.

If no argument is supplied, this method returns the minimum temperature for which all parameterizations are valid. If an integer index k is supplied, then the value returned is the minimum temperature for species k in the phase.

Parameters
 k Species index

Definition at line 460 of file VPSSMgr.cpp.

References VPSSMgr::m_minTemp, VPSSMgr::m_vptp_ptr, PDSS::minTemp(), and Cantera::npos.

 doublereal maxTemp ( size_t k = npos ) const
virtualinherited

Maximum temperature.

If no argument is supplied, this method returns the maximum temperature for which all parameterizations are valid. If an integer index k is supplied, then the value returned is the maximum temperature for parameterization k.

Parameters
 k Species Index

Definition at line 469 of file VPSSMgr.cpp.

References VPSSMgr::m_maxTemp, VPSSMgr::m_vptp_ptr, PDSS::maxTemp(), and Cantera::npos.

 doublereal refPressure ( size_t k = npos ) const
virtualinherited

The reference-state pressure for the standard state.

returns the reference state pressure in Pascals for species k. If k is left out of the argument list, it returns the reference state pressure for the first species. Note that some SpeciesThermo implementations, such as those for ideal gases, require that all species in the same phase have the same reference state pressures.

Parameters
 k Species index. Default is -1, which returns the generic answer.

Definition at line 478 of file VPSSMgr.cpp.

References VPSSMgr::m_p0, VPSSMgr::m_vptp_ptr, Cantera::npos, and PDSS::refPressure().

Referenced by PDSS::initThermoXML(), and IdealSolnGasVPSS::setToEquilState().

 void initLengths ( )
inherited

Initialize the lengths within the object.

Note this function is not virtual

Definition at line 364 of file VPSSMgr.cpp.

Referenced by VPSSMgr_General::initThermo(), and VPSSMgr::initThermo().

 void installSTSpecies ( size_t k, const XML_Node & speciesNode, const XML_Node * phaseNode_ptr )
inherited

Install specific content for species k in the reference-state thermodynamic SpeciesManager object.

This occurs before matrices are sized appropriately.

Parameters
 k Species index in the phase speciesNode XML Node corresponding to the species phaseNode_ptr Pointer to the XML Node corresponding to the phase which owns the species

Definition at line 440 of file VPSSMgr.cpp.

## Member Data Documentation

private

Pointer to the Water PDSS object.

This is a shallow copy. The water PDSS object is owned by the VPStandardStateTP object.

Definition at line 315 of file VPSSMgr_Water_ConstVol.h.

 SpeciesThermo* m_spthermo
protectedinherited

Pointer to reference state thermo calculator.

Note, this can have a value of 0

Definition at line 794 of file VPSSMgr.h.

 doublereal m_tlast
mutableprotectedinherited
 doublereal m_plast
mutableprotectedinherited
 doublereal m_p0
mutableprotectedinherited

Reference pressure (Pa) must be the same for all species

• defaults to 1 atm.

Definition at line 808 of file VPSSMgr.h.

 doublereal m_minTemp
protectedinherited

minimum temperature for the standard state calculations

Definition at line 811 of file VPSSMgr.h.

 doublereal m_maxTemp
protectedinherited

maximum temperature for the standard state calculations

Definition at line 814 of file VPSSMgr.h.

 bool m_useTmpRefStateStorage
protectedinherited

boolean indicating whether temporary reference state storage is used -> default is false

Definition at line 820 of file VPSSMgr.h.

 vector_fp m_h0_RT
mutableprotectedinherited

Vector containing the species reference enthalpies at T = m_tlast and P = p_ref.

Definition at line 826 of file VPSSMgr.h.

 vector_fp m_cp0_R
mutableprotectedinherited

Vector containing the species reference constant pressure heat capacities at T = m_tlast and P = p_ref.

Definition at line 832 of file VPSSMgr.h.

 vector_fp m_g0_RT
mutableprotectedinherited

Vector containing the species reference Gibbs functions at T = m_tlast and P = p_ref.

Definition at line 838 of file VPSSMgr.h.

 vector_fp m_s0_R
mutableprotectedinherited

Vector containing the species reference entropies at T = m_tlast and P = p_ref.

Definition at line 844 of file VPSSMgr.h.

 vector_fp m_V0
mutableprotectedinherited

Vector containing the species reference molar volumes.

Definition at line 847 of file VPSSMgr.h.

 bool m_useTmpStandardStateStorage
protectedinherited

boolean indicating whether temporary standard state storage is used -> default is false

Definition at line 853 of file VPSSMgr.h.

 vector_fp m_hss_RT
mutableprotectedinherited

Vector containing the species Standard State enthalpies at T = m_tlast and P = m_plast.

Definition at line 859 of file VPSSMgr.h.

 vector_fp m_cpss_R
mutableprotectedinherited

Vector containing the species Standard State constant pressure heat capacities at T = m_tlast and P = m_plast.

Definition at line 865 of file VPSSMgr.h.

 vector_fp m_gss_RT
mutableprotectedinherited

Vector containing the species Standard State Gibbs functions at T = m_tlast and P = m_plast.

Definition at line 871 of file VPSSMgr.h.

 vector_fp m_sss_R
mutableprotectedinherited

Vector containing the species Standard State entropies at T = m_tlast and P = m_plast.

Definition at line 877 of file VPSSMgr.h.

 vector_fp m_Vss
mutableprotectedinherited
 vector_fp mPDSS_h0_RT
mutableprotectedinherited

species reference enthalpies - used by individual PDSS objects

Vector containing the species reference enthalpies at T = m_tlast and P = p_ref.

Definition at line 891 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

 vector_fp mPDSS_cp0_R
mutableprotectedinherited

species reference heat capacities - used by individual PDSS objects

Vector containing the species reference constant pressure heat capacities at T = m_tlast and P = p_ref.

Definition at line 898 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

 vector_fp mPDSS_g0_RT
mutableprotectedinherited

species reference gibbs free energies - used by individual PDSS objects

Vector containing the species reference Gibbs functions at T = m_tlast and P = p_ref.

Definition at line 905 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

 vector_fp mPDSS_s0_R
mutableprotectedinherited

species reference entropies - used by individual PDSS objects

Vector containing the species reference entropies at T = m_tlast and P = p_ref.

Definition at line 912 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

 vector_fp mPDSS_V0
mutableprotectedinherited

species reference state molar Volumes - used by individual PDSS objects

Vector containing the rf molar volumes at T = m_tlast and P = p_ref.

Definition at line 920 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

 vector_fp mPDSS_hss_RT
mutableprotectedinherited

species standard state enthalpies - used by individual PDSS objects

Vector containing the species standard state enthalpies at T = m_tlast and P = p_ref.

Definition at line 927 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

 vector_fp mPDSS_cpss_R
mutableprotectedinherited

species standard state heat capacities - used by individual PDSS objects

Vector containing the species standard state constant pressure heat capacities at T = m_tlast and P = p_ref.

Definition at line 934 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

 vector_fp mPDSS_gss_RT
mutableprotectedinherited

species standard state gibbs free energies - used by individual PDSS objects

Vector containing the species standard state Gibbs functions at T = m_tlast and P = p_ref.

Definition at line 941 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

 vector_fp mPDSS_sss_R
mutableprotectedinherited

species standard state entropies - used by individual PDSS objects

Vector containing the species standard state entropies at T = m_tlast and P = p_ref.

Definition at line 948 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

 vector_fp mPDSS_Vss
mutableprotectedinherited

species standard state molar Volumes - used by individual PDSS objects

Vector containing the ss molar volumes at T = m_tlast and P = p_ref.

Definition at line 955 of file VPSSMgr.h.

Referenced by VPSSMgr::initLengths(), PDSS::initPtrs(), and VPSSMgr::operator=().

The documentation for this class was generated from the following files: