mpqc::ci::Vector Struct Reference

Block CI Vector, with 1-d (vector) and 2-d (matrix) access. More...

#include <mpqc/ci/vector.hpp>

Inheritance diagram for mpqc::ci::Vector:

Classes
struct	Block1d
	1-d vector sub-block More...
struct	Block2d
	2-d vector sub-block More...

Public Member Functions
	Vector (std::string name, const SubspaceGrid &G, MPI::Comm comm, bool incore)
	Construct vector. More...
Block1d	operator() (range r)
	Returns 1-d sub-block of vector. More...
Block2d	operator() (mpqc::range A, mpqc::range B)
	Returns 2-d sub-block of vector.
void	sync ()

Detailed Description

Block CI Vector, with 1-d (vector) and 2-d (matrix) access.

Constructor & Destructor Documentation

Vector()

mpqc::ci::Vector::Vector ( std::string  name, const SubspaceGrid &  G, MPI::Comm  comm, bool  incore  )

inline

Construct vector.

Parameters

name	vector name
G	vector grid (blocking and sparsity)
comm	MPI communicator
incore	store vector in core (incore=true) or in file

References mpqc::ci::SubspaceGrid::allowed(), mpqc::ci::SubspaceGrid::alpha(), mpqc::ci::SubspaceGrid::beta(), and mpqc::ci::SubspaceGrid::dets().

Member Function Documentation

operator()()

Block1d mpqc::ci::Vector::operator() ( range  r )

inline

Returns 1-d sub-block of vector.

Parameters

r	sub-block range

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

• src/lib/mpqc/ci/vector.hpp