madness::CompositeFactory< T, NDIM, MDIM > Class Template Reference

Factory for facile setup of a CompositeFunctorInterface and its FuncImpl. More...

#include <function_factory.h>

Inheritance diagram for madness::CompositeFactory< T, NDIM, MDIM >:

Collaboration diagram for madness::CompositeFactory< T, NDIM, MDIM >:

Public Member Functions
	CompositeFactory (World &world)
CompositeFactory &	ket (const Function< T, NDIM > &f)
	provide directly the NDIM (6D) pair function ket More...
CompositeFactory &	g12 (const Function< T, NDIM > &f)
	g12 is the interaction potential (6D) More...
CompositeFactory &	V_for_particle1 (const Function< T, MDIM > &f)
	a one-particle potential, acting on particle 1 More...
CompositeFactory &	V_for_particle2 (const Function< T, MDIM > &f)
	a one-particle potential, acting on particle 2 More...
CompositeFactory &	particle1 (const Function< T, MDIM > &f)
CompositeFactory &	particle2 (const Function< T, MDIM > &f)
std::shared_ptr < FunctionFunctorInterface< T, NDIM > >	get_functor () const
	return the functor; override this if the functor needs deferred construction More...
CompositeFactory &	self ()
Public Member Functions inherited from madness::FunctionFactory< T, NDIM >
	FunctionFactory (World &world)
virtual	~FunctionFactory ()
FunctionFactory &	functor (const std::shared_ptr< FunctionFunctorInterface< T, NDIM > > &f)
template<typename opT >
FunctionFactory &	functor2 (const opT &op)
FunctionFactory &	no_functor ()
FunctionFactory &	f (T(*f)(const coordT &))
virtual FunctionFactory &	k (int k)
virtual FunctionFactory &	thresh (double thresh)
FunctionFactory &	initial_level (int initial_level)
FunctionFactory &	max_refine_level (int max_refine_level)
FunctionFactory &	truncate_mode (int truncate_mode)
FunctionFactory &	refine (bool refine=true)
FunctionFactory &	norefine (bool norefine=true)
FunctionFactory &	empty ()
FunctionFactory &	autorefine ()
FunctionFactory &	noautorefine ()
FunctionFactory &	truncate_on_project ()
FunctionFactory &	notruncate_on_project ()
FunctionFactory &	fence (bool fence=true)
FunctionFactory &	nofence ()
virtual FunctionFactory &	is_on_demand ()
FunctionFactory &	pmap (const std::shared_ptr< WorldDCPmapInterface< Key< NDIM > > > &pmap)
int	get_k () const
double	get_thresh () const
World &	get_world () const
FunctionFactory &	self ()
	implement this in all derived classes for correct chaining More...

Public Attributes
std::shared_ptr< FunctionImpl < T, NDIM > >	_ket
	supposedly a 6D pair function ket More...
std::shared_ptr< FunctionImpl < T, NDIM > >	_g12
	supposedly a interaction potential More...
std::shared_ptr< FunctionImpl < T, MDIM > >	_v1
	supposedly a potential for particle 1 More...
std::shared_ptr< FunctionImpl < T, MDIM > >	_v2
	supposedly a potential for particle 2 More...
std::shared_ptr< FunctionImpl < T, MDIM > >	_particle1
	supposedly particle 1 More...
std::shared_ptr< FunctionImpl < T, MDIM > >	_particle2
	supposedly particle 2 More...

Friends
class	CompositeFunctorInterface< T, NDIM, MDIM >

Additional Inherited Members
Protected Attributes inherited from madness::FunctionFactory< T, NDIM >
World &	_world
int	_k
double	_thresh
int	_initial_level
int	_max_refine_level
int	_truncate_mode
bool	_refine
bool	_empty
bool	_autorefine
bool	_truncate_on_project
bool	_fence
bool	_is_on_demand
std::shared_ptr < WorldDCPmapInterface< Key < NDIM > > >	_pmap

Detailed Description

template<typename T, std::size_t NDIM, std::size_t MDIM>
class madness::CompositeFactory< T, NDIM, MDIM >

Factory for facile setup of a CompositeFunctorInterface and its FuncImpl.

for the concept of a Factory see base class FunctionFactory here we need to provide two different dimensions, since the main purpose of this is to set up a pair function (6D), consisting of orbitals (3D), and also one- and two-electron potentials This Factory constructs a FuncImpl, and also the functor to it.

NOTE: pass in only copies of functions, since use in here will corrupt the tree structure and functions will not pass the VERIFY test after this.

Constructor & Destructor Documentation

template<typename T, std::size_t NDIM, std::size_t MDIM>

madness::CompositeFactory< T, NDIM, MDIM >::CompositeFactory ( World &  world )

inline

Member Function Documentation

template<typename T, std::size_t NDIM, std::size_t MDIM>

CompositeFactory& madness::CompositeFactory< T, NDIM, MDIM >::g12 ( const Function< T, NDIM > &  f )

inline

g12 is the interaction potential (6D)

References madness::Function< T, NDIM >::get_impl().

template<typename T, std::size_t NDIM, std::size_t MDIM>

std::shared_ptr<FunctionFunctorInterface<T, NDIM> > madness::CompositeFactory< T, NDIM, MDIM >::get_functor ( ) const

inlinevirtual

return the functor; override this if the functor needs deferred construction

Reimplemented from madness::FunctionFactory< T, NDIM >.

template<typename T, std::size_t NDIM, std::size_t MDIM>

CompositeFactory& madness::CompositeFactory< T, NDIM, MDIM >::ket ( const Function< T, NDIM > &  f )

inline

provide directly the NDIM (6D) pair function ket

References madness::Function< T, NDIM >::get_impl().

Referenced by apply_U_mix(), compute_R2f2_psi(), reconstruct_psi(), and test_U_el().

template<typename T, std::size_t NDIM, std::size_t MDIM>

CompositeFactory& madness::CompositeFactory< T, NDIM, MDIM >::particle1 ( const Function< T, MDIM > &  f )

inline

provide particle 1, used with particle 2 to set up a pair function by direct product

References madness::Function< T, NDIM >::get_impl().

Referenced by compute_energy().

template<typename T, std::size_t NDIM, std::size_t MDIM>

CompositeFactory& madness::CompositeFactory< T, NDIM, MDIM >::particle2 ( const Function< T, MDIM > &  f )

inline

provide particle 2, used with particle 1 to set up a pair function by direct product

References madness::Function< T, NDIM >::get_impl().

Referenced by compute_energy().

template<typename T, std::size_t NDIM, std::size_t MDIM>

CompositeFactory& madness::CompositeFactory< T, NDIM, MDIM >::self ( )

inline

template<typename T, std::size_t NDIM, std::size_t MDIM>

CompositeFactory& madness::CompositeFactory< T, NDIM, MDIM >::V_for_particle1 ( const Function< T, MDIM > &  f )

inline

a one-particle potential, acting on particle 1

References madness::Function< T, NDIM >::get_impl().

Referenced by apply_U_ncf().

template<typename T, std::size_t NDIM, std::size_t MDIM>

CompositeFactory& madness::CompositeFactory< T, NDIM, MDIM >::V_for_particle2 ( const Function< T, MDIM > &  f )

inline

a one-particle potential, acting on particle 2

References madness::Function< T, NDIM >::get_impl().

Referenced by apply_U_mix(), and apply_U_ncf().

Friends And Related Function Documentation

template<typename T, std::size_t NDIM, std::size_t MDIM>

friend class CompositeFunctorInterface< T, NDIM, MDIM >

friend

Member Data Documentation

template<typename T, std::size_t NDIM, std::size_t MDIM>

std::shared_ptr<FunctionImpl<T,NDIM> > madness::CompositeFactory< T, NDIM, MDIM >::_g12

supposedly a interaction potential

template<typename T, std::size_t NDIM, std::size_t MDIM>

std::shared_ptr<FunctionImpl<T,NDIM> > madness::CompositeFactory< T, NDIM, MDIM >::_ket

supposedly a 6D pair function ket

template<typename T, std::size_t NDIM, std::size_t MDIM>

std::shared_ptr<FunctionImpl<T,MDIM> > madness::CompositeFactory< T, NDIM, MDIM >::_particle1

supposedly particle 1

template<typename T, std::size_t NDIM, std::size_t MDIM>

std::shared_ptr<FunctionImpl<T,MDIM> > madness::CompositeFactory< T, NDIM, MDIM >::_particle2

supposedly particle 2

template<typename T, std::size_t NDIM, std::size_t MDIM>

std::shared_ptr<FunctionImpl<T,MDIM> > madness::CompositeFactory< T, NDIM, MDIM >::_v1

supposedly a potential for particle 1

template<typename T, std::size_t NDIM, std::size_t MDIM>

std::shared_ptr<FunctionImpl<T,MDIM> > madness::CompositeFactory< T, NDIM, MDIM >::_v2

supposedly a potential for particle 2

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

• function_factory.h