Attaches a unit to a Vector for IO. More...

Inheritance diagram for ParticleAttrib< T, Alloc >:

Collaboration diagram for ParticleAttrib< T, Alloc >:

Public Member Functions
	ParticleAttrib (size_t n=0)
	constructor with size n More...

	ParticleAttrib (T *ref, size_t n)
	constructor with an initialized ref More...

	ParticleAttrib (const ParticleAttrib &rhs)=default

	ParticleAttrib (std::initializer_list< T > ts)

ParticleAttrib &	operator= (const ParticleAttrib &rhs)=default

template<class RHS >
ParticleAttrib &	operator= (const RHS &rhs)
	assignment operator to enable PETE More...

OhmmsObject *	makeClone () const override

bool	get (std::ostream &os) const override
	Specialized to write the unit. More...

bool	put (std::istream &is) override
	Specialized to read the unit. More...

bool	put (xmlNodePtr cur) override
	read from an xmlNode More...

void	reset () override
	reset member data More...


void	setUnit (PosUnit i)

PosUnit	getUnit () const

Public Member Functions inherited from Vector< T, Alloc >
	Vector (size_type n=0, Type_t val=Type_t())
	constructor with size n More...

	Vector (T *ref, size_type n)
	constructor with an initialized ref More...

	Vector (const Vector &rhs)
	copy constructor More...

template<typename CONTAINER >
	Vector (const CONTAINER &from, T *ref, size_type n)
	This allows construction of a Vector on another containers owned memory that is using a dualspace allocator. More...

template<typename Allocator = Alloc, typename = IsHostSafe<Allocator>>
	Vector (std::initializer_list< T > ts)
	Initializer list constructor that can deal with both POD and nontrivial nested elements with move assignment operators. More...

Vector &	operator= (const Vector &rhs)

template<typename T1 , typename C1 , typename Allocator = Alloc, typename = IsHostSafe<Allocator>>
Vector &	operator= (const Vector< T1, C1 > &rhs)

template<class RHS , typename Allocator = Alloc, typename = IsHostSafe<Allocator>>
Vector &	operator= (const RHS &rhs)

virtual	~Vector ()
	Destructor. More...

void	attachReference (T *ref, size_type n)

template<typename CONTAINER >
void	attachReference (const CONTAINER &other, T *ref, size_type n)
	Attach to pre-allocated memory and propagate the allocator of the owning container. More...

size_type	size () const
	return the current size More...

void	resize (size_type n, Type_t val=Type_t())
	Resize the container. More...

void	clear ()
	clear More...

void	zero ()

void	free ()
	free More...

template<typename Allocator = Alloc, typename = IsHostSafe<Allocator>>
Type_t &	operator[] (size_type i)

template<typename Allocator = Alloc, typename = IsHostSafe<Allocator>>
const Type_t &	operator[] (size_type i) const

iterator	begin ()

const_iterator	begin () const

iterator	end ()

const_iterator	end () const

pointer	data ()

const_pointer	data () const

template<typename Allocator = Alloc, typename = IsDualSpace<Allocator>>
pointer	device_data ()
	Return the device_ptr matching X if this is a vector attached or owning dual space memory. More...

template<typename Allocator = Alloc, typename = IsDualSpace<Allocator>>
const_pointer	device_data () const

pointer	first_address ()

const_pointer	first_address () const

pointer	last_address ()

const_pointer	last_address () const

template<typename Allocator = Alloc, typename = IsDualSpace<Allocator>>
void	updateTo (size_type size=0, std::ptrdiff_t offset=0)

template<typename Allocator = Alloc, typename = IsDualSpace<Allocator>>
void	updateFrom (size_type size=0, std::ptrdiff_t offset=0)

Public Member Functions inherited from OhmmsObject
	OhmmsObject ()
	default constructor More...

	OhmmsObject (const std::string &tname, const std::string &oname)
	contructor More...

	~OhmmsObject () override

int	id () const
	return the ObjectID which is unique to each object More...

void	setID (int i)
	overwrite ObjectID More...

int	elementByteSize () const
	returns the byte size of the object More...

void	setTypeName (const std::string &tname)
	set the type name More...

void	setObjName (const std::string &oname)
	set the object name More...

const std::string &	typeName () const
	return the type name More...

const std::string &	objName () const
	return the object name More...

Public Member Functions inherited from OhmmsElementBase
	OhmmsElementBase (const char *aname="none")
	constructor with a name More...

virtual	~OhmmsElementBase ()
	destructor More...

const std::string &	getName () const
	return the name More...

void	setName (const std::string &aname)
	set name More...

void	setIOMode (int imode)
	set iomode More...

virtual bool	add (xmlNodePtr parent)
	add a xmlNode to the children list of parent More...

void	put (const std::string &s)
	read from string More...

virtual void	begin_node (std::ostream &os) const
	write the start of a node More...

virtual void	end_node (std::ostream &os) const
	write the end of a node More...

Public Attributes
PosUnit	InUnit
	The unit type. More...

Private Types
using	__my_base = Vector< T, Alloc >

Additional Inherited Members
Public Types inherited from Vector< T, Alloc >
using	Type_t = T

using	value_type = T

using	iterator = T *

using	const_iterator = const T *

using	size_type = typename Alloc::size_type

using	pointer = typename Alloc::pointer

using	const_pointer = typename Alloc::const_pointer

using	This_t = Vector< T, Alloc >

Public Types inherited from OhmmsElementBase
enum	{ useLIBXML = 0, useLIBXMLPP, usePLAIN }
	enumeration to choose the xml parser More...

Protected Attributes inherited from OhmmsObject
std::string	TypeName
	the type name of this object More...

int	ObjectID
	the unique ID of this object More...

int	ElementByteSize
	the byte size of this object More...

Protected Attributes inherited from OhmmsElementBase
int	myIOMode
	the type of IO mode: default is useLIBXML More...

std::string	myName
	the name of the node, corresponds to the xml tag More...

Detailed Description

template<class T, typename Alloc = std::allocator<T>>
class qmcplusplus::ParticleAttrib< T, Alloc >

Attaches a unit to a Vector for IO.

Makes Vect

Definition at line 33 of file ParticleAttrib.h.

Member Typedef Documentation

◆ __my_base

using __my_base = Vector<T, Alloc>

private

Definition at line 35 of file ParticleAttrib.h.

Constructor & Destructor Documentation

◆ ParticleAttrib() [1/4]

ParticleAttrib ( size_t n = 0 )

inlineexplicit

constructor with size n

Definition at line 42 of file ParticleAttrib.h.

42 : __my_base(n), InUnit(PosUnit::Cartesian) {}

qmcplusplus::ParticleAttrib::__my_base

Vector< T, Alloc > __my_base

Definition: ParticleAttrib.h:35

qmcplusplus::PosUnit::Cartesian

qmcplusplus::n

int n

Definition: test_cuBLAS_LU.cpp:216

qmcplusplus::ParticleAttrib::InUnit

PosUnit InUnit

The unit type.

Definition: ParticleAttrib.h:39

◆ ParticleAttrib() [2/4]

ParticleAttrib	(	T *	ref,
		size_t	n
	)

inlineexplicit

constructor with an initialized ref

Definition at line 45 of file ParticleAttrib.h.

45 : __my_base(ref, n), InUnit(PosUnit::Cartesian) {}

qmcplusplus::ParticleAttrib::__my_base

Vector< T, Alloc > __my_base

Definition: ParticleAttrib.h:35

qmcplusplus::PosUnit::Cartesian

qmcplusplus::n

int n

Definition: test_cuBLAS_LU.cpp:216

qmcplusplus::ParticleAttrib::InUnit

PosUnit InUnit

The unit type.

Definition: ParticleAttrib.h:39

◆ ParticleAttrib() [3/4]

ParticleAttrib ( const ParticleAttrib< T, Alloc > & rhs )

default

◆ ParticleAttrib() [4/4]

ParticleAttrib ( std::initializer_list< T > ts )

inline

Definition at line 49 of file ParticleAttrib.h.

49 : __my_base(ts), InUnit(PosUnit::Cartesian){};

qmcplusplus::ParticleAttrib::__my_base

Vector< T, Alloc > __my_base

Definition: ParticleAttrib.h:35

qmcplusplus::PosUnit::Cartesian

qmcplusplus::ParticleAttrib::InUnit

PosUnit InUnit

The unit type.

Definition: ParticleAttrib.h:39

Member Function Documentation

◆ get()

bool get ( std::ostream & os ) const

inlineoverridevirtual

Specialized to write the unit.

Returns: true, if the attribute is relative to a unit

Ad hoc get function to tell users if this attribute is absolute or relative value. E.g., is Cartesian unit vs Lattice unit.

Implements OhmmsElementBase.

Definition at line 74 of file ParticleAttrib.h.

   {
     os << InUnit;
     return true;
   }

◆ getUnit()

PosUnit getUnit ( ) const

inline

Definition at line 63 of file ParticleAttrib.h.

63 { return InUnit; }

qmcplusplus::ParticleAttrib::InUnit

PosUnit InUnit

The unit type.

Definition: ParticleAttrib.h:39

◆ makeClone()

OhmmsObject* makeClone ( ) const

inlineoverridevirtual

Implements OhmmsObject.

Definition at line 66 of file ParticleAttrib.h.

66 { return new ParticleAttrib<T, Alloc>(*this); }

◆ operator=() [1/2]

ParticleAttrib& operator= ( const ParticleAttrib< T, Alloc > & rhs )

inlinedefault

◆ operator=() [2/2]

ParticleAttrib& operator= ( const RHS & rhs )

inline

assignment operator to enable PETE

Definition at line 55 of file ParticleAttrib.h.

   {
     assign(*this, rhs);
     return *this;
   }

◆ put() [1/2]

bool put ( std::istream & is )

inlineoverridevirtual

Specialized to read the unit.

Implements OhmmsElementBase.

Definition at line 82 of file ParticleAttrib.h.

   {
     is >> InUnit;
     return true;
   }

◆ put() [2/2]

bool put ( xmlNodePtr cur )

inlineoverridevirtual

read from an xmlNode

Implements OhmmsElementBase.

Definition at line 89 of file ParticleAttrib.h.

89 { return true; }

◆ reset()

void reset ( )

inlineoverridevirtual

reset member data

Implements OhmmsElementBase.

Definition at line 92 of file ParticleAttrib.h.

92 {}

◆ setUnit()

void setUnit ( PosUnit i )

inline

Definition at line 62 of file ParticleAttrib.h.

Referenced by InitMolecularSystem::initWithVolume(), and XMLParticleParser::readXML().

62 { InUnit = i; }

qmcplusplus::ParticleAttrib::InUnit

PosUnit InUnit

The unit type.

Definition: ParticleAttrib.h:39

Member Data Documentation

◆ InUnit

PosUnit InUnit

The unit type.

Definition at line 39 of file ParticleAttrib.h.

Referenced by ParticleAttrib< qmcplusplus::TinyVector >::get(), ParticleAttrib< qmcplusplus::TinyVector >::getUnit(), ParticleSet::ParticleSet(), ParticleAttrib< qmcplusplus::TinyVector >::put(), and ParticleAttrib< qmcplusplus::TinyVector >::setUnit().

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

/home/pk7/projects/qmc/for_cron_doxygen/qmcpack/src/Particle/ParticleBase/ParticleAttrib.h

Public Member Functions

Public Attributes

Private Types

Additional Inherited Members

Detailed Description

template<class T, typename Alloc = std::allocator<T>> class qmcplusplus::ParticleAttrib< T, Alloc >

Member Typedef Documentation

◆ __my_base

Constructor & Destructor Documentation

◆ ParticleAttrib() [1/4]

◆ ParticleAttrib() [2/4]

◆ ParticleAttrib() [3/4]

◆ ParticleAttrib() [4/4]

Member Function Documentation

◆ get()

◆ getUnit()

◆ makeClone()

◆ operator=() [1/2]

◆ operator=() [2/2]

◆ put() [1/2]

◆ put() [2/2]

◆ reset()

◆ setUnit()

Member Data Documentation

◆ InUnit

template<class T, typename Alloc = std::allocator<T>>
class qmcplusplus::ParticleAttrib< T, Alloc >