molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt > Struct Template Reference

Container storing the Q space parameters. More...

#include <QSpace.h>

Detailed Description

template<class Rt, class Qt, class Pt>
struct molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >

Container storing the Q space parameters.

Template Parameters

R	array for R space
Q	array for Q space
P	array for P space

Public Types
using	R = Rt
using	Q = Qt
using	P = Pt
using	value_type = typename array::ArrayHandler< R, R >::value_type
using	value_type_abs = typename array::ArrayHandler< R, R >::value_type_abs

Public Member Functions
	QSpace (std::shared_ptr< ArrayHandlers< R, Q, P > > handlers, std::shared_ptr< Logger > logger)
template<typename T >
void	update (const CVecRef< R > &params, const CVecRef< R > &actions, const SubspaceData< T > &qq_in, const SubspaceData< T > &qx_in, const SubspaceData< T > &xq_in, const Dimensions &dims, SubspaceData< T > &old_data)
	Prepends parameters to the start of Q space.
void	clear ()
void	erase (size_t i)
	Erases q parameter i.
size_t	size () const
VecRef< Q >	params ()
CVecRef< Q >	params () const
CVecRef< Q >	cparams () const
VecRef< Q >	actions ()
CVecRef< Q >	actions () const
CVecRef< Q >	cactions () const

Protected Attributes
std::shared_ptr< ArrayHandlers< R, Q, P > >	m_handlers
std::shared_ptr< Logger >	m_logger
size_t	m_unique_id {0}
	unique id for any new parameter set
std::list< qspace::QParam< Q > >	m_params
	q parameter sets with new parameters first

Member Typedef Documentation

P

template<class Rt , class Qt , class Pt >

using molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::P = Pt

Q

template<class Rt , class Qt , class Pt >

using molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::Q = Qt

R

template<class Rt , class Qt , class Pt >

using molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::R = Rt

value_type

template<class Rt , class Qt , class Pt >

using molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::value_type = typename array::ArrayHandler<R, R>::value_type

value_type_abs

template<class Rt , class Qt , class Pt >

using molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::value_type_abs = typename array::ArrayHandler<R, R>::value_type_abs

Constructor & Destructor Documentation

QSpace()

template<class Rt , class Qt , class Pt >

molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::QSpace ( std::shared_ptr< ArrayHandlers< R, Q, P > >  handlers, std::shared_ptr< Logger >  logger  )

inlineexplicit

Member Function Documentation

actions() [1/2]

template<class Rt , class Qt , class Pt >

VecRef< Q > molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::actions ( )

inline

actions() [2/2]

template<class Rt , class Qt , class Pt >

CVecRef< Q > molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::actions ( ) const

inline

cactions()

template<class Rt , class Qt , class Pt >

CVecRef< Q > molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::cactions ( ) const

inline

clear()

template<class Rt , class Qt , class Pt >

void molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::clear ( )

inline

cparams()

template<class Rt , class Qt , class Pt >

CVecRef< Q > molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::cparams ( ) const

inline

erase()

template<class Rt , class Qt , class Pt >

void molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::erase ( size_t  i )

inline

Erases q parameter i.

Parameters

i	index in the current Q space

params() [1/2]

template<class Rt , class Qt , class Pt >

VecRef< Q > molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::params ( )

inline

params() [2/2]

template<class Rt , class Qt , class Pt >

CVecRef< Q > molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::params ( ) const

inline

size()

template<class Rt , class Qt , class Pt >

size_t molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::size ( ) const

inline

update()

template<class Rt , class Qt , class Pt >

template<typename T >

void molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::update ( const CVecRef< R > &  params, const CVecRef< R > &  actions, const SubspaceData< T > &  qq_in, const SubspaceData< T > &  qx_in, const SubspaceData< T > &  xq_in, const Dimensions &  dims, SubspaceData< T > &  old_data  )

inline

Prepends parameters to the start of Q space.

New parameters that are linearly dependent among themselves are discarded, together with the corresponding rows and columns of the equation data.

Parameters

params	new parameters
actions	new actions
qq_in	Equation data block between new Q parameters
qx_in	data block between new Q parameters and current X space
xq_in	data block between current X space and the new Q parameters
dims	current dimensions
old_data	current data

Member Data Documentation

m_handlers

template<class Rt , class Qt , class Pt >

std::shared_ptr<ArrayHandlers<R, Q, P> > molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::m_handlers

protected

m_logger

template<class Rt , class Qt , class Pt >

std::shared_ptr<Logger> molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::m_logger

protected

m_params

template<class Rt , class Qt , class Pt >

std::list<qspace::QParam<Q> > molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::m_params

protected

q parameter sets with new parameters first

m_unique_id

template<class Rt , class Qt , class Pt >

size_t molpro::linalg::itsolv::subspace::QSpace< Rt, Qt, Pt >::m_unique_id {0}

protected

unique id for any new parameter set