GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo > Class Template Reference

Wrapper class for evaluating chemistry and thermo properties using Antioch. More...

#include <antioch_evaluator.h>

Inheritance diagram for GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >:

Public Member Functions
	AntiochEvaluator (const AntiochMixture< KineticsThermoCurveFit > &mixture)
virtual	~AntiochEvaluator ()
libMesh::Real	M (unsigned int species) const
libMesh::Real	M_mix (const std::vector< libMesh::Real > &mass_fractions) const
libMesh::Real	R (unsigned int species) const
libMesh::Real	R_mix (const std::vector< libMesh::Real > &mass_fractions) const
libMesh::Real	X (unsigned int species, libMesh::Real M, libMesh::Real mass_fraction) const
void	X (libMesh::Real M, const std::vector< libMesh::Real > &mass_fractions, std::vector< libMesh::Real > &mole_fractions) const
unsigned int	species_index (const std::string &species_name) const
std::string	species_name (unsigned int species_index) const
libMesh::Real	cp (const libMesh::Real &T, const libMesh::Real P, const std::vector< libMesh::Real > &Y)
libMesh::Real	cv (const libMesh::Real &T, const libMesh::Real P, const std::vector< libMesh::Real > &Y)
libMesh::Real	h_s (const libMesh::Real &T, unsigned int species)
void	omega_dot (const libMesh::Real &T, libMesh::Real rho, const std::vector< libMesh::Real > mass_fractions, std::vector< libMesh::Real > &omega_dot)
template<>
libMesh::Real	cp (const libMesh::Real &T, const libMesh::Real, const std::vector< libMesh::Real > &Y)
template<>
libMesh::Real	cv (const libMesh::Real &T, const libMesh::Real, const std::vector< libMesh::Real > &Y)
template<>
libMesh::Real	h_s (const libMesh::Real &T, unsigned int species)
template<>
libMesh::Real	cp (const libMesh::Real &T, const libMesh::Real, const std::vector< libMesh::Real > &Y)
template<>
libMesh::Real	cv (const libMesh::Real &T, const libMesh::Real, const std::vector< libMesh::Real > &Y)
template<>
libMesh::Real	h_s (const libMesh::Real &T, unsigned int species)

Protected Member Functions
void	check_and_reset_temp_cache (const libMesh::Real &T)
	Helper method for managing _temp_cache. More...
void	build_thermo (const AntiochMixture< KineticsThermoCurveFit > &mixture)

Protected Attributes
const AntiochMixture< KineticsThermoCurveFit > &	_chem
libMesh::UniquePtr< Thermo >	_thermo
	Primary thermo object. More...
libMesh::UniquePtr< Antioch::NASAEvaluator< libMesh::Real, KineticsThermoCurveFit > >	_nasa_evaluator
	For some Thermo types, we also need to cache a NASAEvaluator. More...
libMesh::UniquePtr< AntiochKinetics< KineticsThermoCurveFit > >	_kinetics
libMesh::Real	_clipped_T
const libMesh::Real	_minimum_T
libMesh::UniquePtr< Antioch::TempCache< libMesh::Real > >	_temp_cache

Private Member Functions
	AntiochEvaluator ()
void	specialized_build_thermo (const AntiochMixture< KineticsThermoCurveFit > &mixture, libMesh::UniquePtr< Antioch::StatMechThermodynamics< libMesh::Real > > &thermo, thermo_type< Antioch::StatMechThermodynamics< libMesh::Real > >)
void	specialized_build_thermo (const AntiochMixture< KineticsThermoCurveFit > &mixture, libMesh::UniquePtr< Antioch::IdealGasMicroThermo< Antioch::NASAEvaluator< libMesh::Real, KineticsThermoCurveFit >, libMesh::Real > > &thermo, thermo_type< Antioch::IdealGasMicroThermo< Antioch::NASAEvaluator< libMesh::Real, KineticsThermoCurveFit >, libMesh::Real > >)

Detailed Description

template<typename KineticsThermoCurveFit, typename Thermo>
class GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >

Wrapper class for evaluating chemistry and thermo properties using Antioch.

This class is expected to be constructed after threads have been forked and will only live during the lifetime of the thread. By default, Antioch is working in SI units. Note that this documentation will always be built regardless if Antioch is included in the GRINS build or not. Check configure output to confirm that Antioch was included in the build.

Definition at line 56 of file antioch_evaluator.h.

Constructor & Destructor Documentation

template<typename KineticsThermoCurveFit, typename Thermo >

GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::AntiochEvaluator

(

const AntiochMixture< KineticsThermoCurveFit > &

mixture

)

Definition at line 44 of file antioch_evaluator.C.

References GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::build_thermo().

    : _chem( mixture ),
      _kinetics( new AntiochKinetics<KineticsThermoCurveFit>(mixture) ),
      _minimum_T( mixture.minimum_T() ),
      _temp_cache( new Antioch::TempCache<libMesh::Real>(1.0) )
  {
    this->build_thermo( mixture );
  }

template<typename KineticsThermoCurveFit, typename Thermo>

virtual GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::~AntiochEvaluator ( )

inlinevirtual

Definition at line 62 of file antioch_evaluator.h.

{};

template<typename KineticsThermoCurveFit, typename Thermo>

GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::AntiochEvaluator ( )

private

Member Function Documentation

template<typename KineticsThermoCurveFit, typename Thermo>

void GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::build_thermo ( const AntiochMixture< KineticsThermoCurveFit > &  mixture )

inlineprotected

Definition at line 125 of file antioch_evaluator.h.

Referenced by GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::AntiochEvaluator().

    { specialized_build_thermo( mixture, _thermo, thermo_type<Thermo>() ); }

template<typename KineticsThermoCurveFit , typename Thermo >

void GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::check_and_reset_temp_cache ( const libMesh::Real &  T )

inlineprotected

Helper method for managing _temp_cache.

T MUST be pass-by-reference because of the structure of Antioch::TempCache!

Definition at line 220 of file antioch_evaluator.h.

  {
    _clipped_T = std::max(_minimum_T, T);

    // We can't compare T because it's a reference, so we may have already
    // changed it upstream. So, we compare the next cheapest thing.
    if( _temp_cache->T2 != _clipped_T*_clipped_T )
      _temp_cache.reset( new Antioch::TempCache<libMesh::Real>(_clipped_T) );
  }

template<>

libMesh::Real GRINS::AntiochEvaluator< Antioch::CEACurveFit< libMesh::Real >, Antioch::IdealGasMicroThermo< Antioch::NASAEvaluator< libMesh::Real, Antioch::CEACurveFit< libMesh::Real > >, libMesh::Real > >::cp	(	const libMesh::Real &	T,
		const libMesh::Real	,
		const std::vector< libMesh::Real > &	Y
	)

Definition at line 67 of file antioch_evaluator.C.

  {
    this->check_and_reset_temp_cache(T);
    return this->_nasa_evaluator->cp( *(_temp_cache.get()), Y );
  }

template<typename KineticsThermoCurveFit, typename Thermo>

libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::cp	(	const libMesh::Real &	T,
		const libMesh::Real	P,
		const std::vector< libMesh::Real > &	Y
	)

Referenced by GRINS::AntiochConstantTransportEvaluator< KineticsThermoCurveFit, Thermo, Conductivity >::k().

template<>

libMesh::Real GRINS::AntiochEvaluator< Antioch::CEACurveFit< libMesh::Real >, Antioch::StatMechThermodynamics< libMesh::Real > >::cp	(	const libMesh::Real &	T,
		const libMesh::Real	,
		const std::vector< libMesh::Real > &	Y
	)

Definition at line 95 of file antioch_evaluator.C.

  {
    return this->_thermo->cp( T, T, Y );
  }

template<>

libMesh::Real GRINS::AntiochEvaluator< Antioch::CEACurveFit< libMesh::Real >, Antioch::IdealGasMicroThermo< Antioch::NASAEvaluator< libMesh::Real, Antioch::CEACurveFit< libMesh::Real > >, libMesh::Real > >::cv	(	const libMesh::Real &	T,
		const libMesh::Real	,
		const std::vector< libMesh::Real > &	Y
	)

Definition at line 77 of file antioch_evaluator.C.

  {
    this->check_and_reset_temp_cache(T);
    return this->_nasa_evaluator->cv( *(_temp_cache.get()), Y );
  }

template<typename KineticsThermoCurveFit, typename Thermo>

libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::cv	(	const libMesh::Real &	T,
		const libMesh::Real	P,
		const std::vector< libMesh::Real > &	Y
	)

template<>

libMesh::Real GRINS::AntiochEvaluator< Antioch::CEACurveFit< libMesh::Real >, Antioch::StatMechThermodynamics< libMesh::Real > >::cv	(	const libMesh::Real &	T,
		const libMesh::Real	,
		const std::vector< libMesh::Real > &	Y
	)

Definition at line 103 of file antioch_evaluator.C.

  {
    return this->_thermo->cv( T, T, Y );
  }

template<>

libMesh::Real GRINS::AntiochEvaluator< Antioch::CEACurveFit< libMesh::Real >, Antioch::IdealGasMicroThermo< Antioch::NASAEvaluator< libMesh::Real, Antioch::CEACurveFit< libMesh::Real > >, libMesh::Real > >::h_s	(	const libMesh::Real &	T,
		unsigned int	species
	)

Definition at line 87 of file antioch_evaluator.C.

  {
    this->check_and_reset_temp_cache(T);

    return this->_nasa_evaluator->h( *(_temp_cache.get()), species );;
  }

template<typename KineticsThermoCurveFit, typename Thermo>

libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::h_s	(	const libMesh::Real &	T,
		unsigned int	species
	)

template<>

libMesh::Real GRINS::AntiochEvaluator< Antioch::CEACurveFit< libMesh::Real >, Antioch::StatMechThermodynamics< libMesh::Real > >::h_s	(	const libMesh::Real &	T,
		unsigned int	species
	)

Definition at line 111 of file antioch_evaluator.C.

  {
    return this->_thermo->h_tot( species, T ) + _chem.h_stat_mech_ref_correction(species);
  }

template<typename KineticsThermoCurveFit , typename Thermo >

libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::M ( unsigned int  species ) const

inline

Definition at line 153 of file antioch_evaluator.h.

  {
    return _chem.M(species);
  }

template<typename KineticsThermoCurveFit , typename Thermo >

libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::M_mix ( const std::vector< libMesh::Real > &  mass_fractions ) const

inline

Definition at line 162 of file antioch_evaluator.h.

  {
    return _chem.M_mix(mass_fractions);
  }

template<typename KineticsThermoCurveFit , typename Thermo >

void GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::omega_dot	(	const libMesh::Real &	T,
		libMesh::Real	rho,
		const std::vector< libMesh::Real >	mass_fractions,
		std::vector< libMesh::Real > &	omega_dot
	)

Definition at line 55 of file antioch_evaluator.C.

  {
    this->check_and_reset_temp_cache(T);

    _kinetics->omega_dot( *(_temp_cache.get()), rho, mass_fractions, omega_dot );
  }

template<typename KineticsThermoCurveFit , typename Thermo >

libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::R ( unsigned int  species ) const

inline

Definition at line 170 of file antioch_evaluator.h.

  {
    return _chem.R(species);
  }

template<typename KineticsThermoCurveFit , typename Thermo >

libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::R_mix ( const std::vector< libMesh::Real > &  mass_fractions ) const

inline

Definition at line 179 of file antioch_evaluator.h.

  {
    return _chem.R_mix(mass_fractions);
  }

template<typename KineticsThermoCurveFit, typename Thermo>

void GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::specialized_build_thermo ( const AntiochMixture< KineticsThermoCurveFit > &  mixture, libMesh::UniquePtr< Antioch::StatMechThermodynamics< libMesh::Real > > &  thermo, thermo_type< Antioch::StatMechThermodynamics< libMesh::Real > >    )

inlineprivate

Definition at line 132 of file antioch_evaluator.h.

Referenced by GRINS::AntiochEvaluator< Antioch::CEACurveFit< libMesh::Real >, Thermo >::build_thermo().

    {
      thermo.reset( new Antioch::StatMechThermodynamics<libMesh::Real>( mixture.chemical_mixture() ) );
    }

template<typename KineticsThermoCurveFit, typename Thermo>

void GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::specialized_build_thermo ( const AntiochMixture< KineticsThermoCurveFit > &  mixture, libMesh::UniquePtr< Antioch::IdealGasMicroThermo< Antioch::NASAEvaluator< libMesh::Real, KineticsThermoCurveFit >, libMesh::Real > > &  thermo, thermo_type< Antioch::IdealGasMicroThermo< Antioch::NASAEvaluator< libMesh::Real, KineticsThermoCurveFit >, libMesh::Real > >    )

inlineprivate

Definition at line 139 of file antioch_evaluator.h.

    {
      _nasa_evaluator.reset( new Antioch::NASAEvaluator<libMesh::Real,KineticsThermoCurveFit>( mixture.nasa_mixture() ) );
      thermo.reset( new Antioch::IdealGasMicroThermo<Antioch::NASAEvaluator<libMesh::Real,KineticsThermoCurveFit>,libMesh::Real>( *_nasa_evaluator, mixture.chemical_mixture() ) );
    }

template<typename KineticsThermoCurveFit , typename Thermo >

unsigned int GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::species_index ( const std::string &  species_name ) const

inline

Definition at line 205 of file antioch_evaluator.h.

  {
    return _chem.species_index(species_name);
  }

template<typename KineticsThermoCurveFit , typename Thermo >

std::string GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::species_name ( unsigned int  species_index ) const

inline

Definition at line 213 of file antioch_evaluator.h.

  {
    return _chem.species_name(species_index);
  }

template<typename KineticsThermoCurveFit , typename Thermo >

libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::X ( unsigned int  species, libMesh::Real  M, libMesh::Real  mass_fraction  ) const

inline

Definition at line 186 of file antioch_evaluator.h.

  {
    return _chem.X(species,M,mass_fraction);
  }

template<typename KineticsThermoCurveFit , typename Thermo >

void GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::X ( libMesh::Real  M, const std::vector< libMesh::Real > &  mass_fractions, std::vector< libMesh::Real > &  mole_fractions  ) const

inline

Definition at line 195 of file antioch_evaluator.h.

  {
    _chem.X(M,mass_fractions,mole_fractions);
  }

Member Data Documentation

template<typename KineticsThermoCurveFit, typename Thermo>

const AntiochMixture<KineticsThermoCurveFit>& GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::_chem

protected

Definition at line 96 of file antioch_evaluator.h.

template<typename KineticsThermoCurveFit, typename Thermo>

libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::_clipped_T

protected

Definition at line 108 of file antioch_evaluator.h.

template<typename KineticsThermoCurveFit, typename Thermo>

libMesh::UniquePtr<AntiochKinetics<KineticsThermoCurveFit> > GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::_kinetics

protected

Definition at line 104 of file antioch_evaluator.h.

template<typename KineticsThermoCurveFit, typename Thermo>

const libMesh::Real GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::_minimum_T

protected

Definition at line 112 of file antioch_evaluator.h.

template<typename KineticsThermoCurveFit, typename Thermo>

libMesh::UniquePtr<Antioch::NASAEvaluator<libMesh::Real,KineticsThermoCurveFit> > GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::_nasa_evaluator

protected

For some Thermo types, we also need to cache a NASAEvaluator.

Definition at line 102 of file antioch_evaluator.h.

template<typename KineticsThermoCurveFit, typename Thermo>

libMesh::UniquePtr<Antioch::TempCache<libMesh::Real> > GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::_temp_cache

protected

Definition at line 114 of file antioch_evaluator.h.

template<typename KineticsThermoCurveFit, typename Thermo>

libMesh::UniquePtr<Thermo> GRINS::AntiochEvaluator< KineticsThermoCurveFit, Thermo >::_thermo

protected

Primary thermo object.

Definition at line 99 of file antioch_evaluator.h.

---

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

• src/properties/include/grins/antioch_evaluator.h
• src/properties/src/antioch_evaluator.C