Reads 1-RDM from a text file. More...

Inheritance diagram for sc::ExternSpinFreeRDMOne:

Public Member Functions
	ExternSpinFreeRDMOne (const std::string &filename, const std::vector< unsigned int > &indexmap, const Ref< OrbitalSpace > &orbs)
	reads 1-rdm from filename assumes that 1-rdm is expressed in orbs_sb
	ExternSpinFreeRDMOne (const RefSymmSCMatrix &rdm, const Ref< OrbitalSpace > &orbs)
	receives 1-rdm as a constructor argument assumes that 1-rdm is expressed in orbs_sb
void	obsolete ()
	cannot be obsoleted
void	compute ()
	already computed
Ref< OrbitalSpace >	orbs () const
	the orbital space in which the density is reported
RefSymmSCMatrix	scmat () const
	density matrix

Detailed Description

Reads 1-RDM from a text file.

Constructor & Destructor Documentation

sc::ExternSpinFreeRDMOne::ExternSpinFreeRDMOne	(	const std::string &	filename,
		const std::vector< unsigned int > &	indexmap,
		const Ref< OrbitalSpace > &	orbs
	)

reads 1-rdm from filename assumes that 1-rdm is expressed in orbs_sb

reads 1-rdm from filename, assumes that 1-rdm is expressed in orbs_sb, indices in file are mapped to orbs_sb via indexmap

Parameters:

filename	file that contains an ASCII text specification of 1-RDM. the file contains 3 columns: row index, column index, value.
indexmap	maps the indices assumed in the file to orbs_sb
orbs_sb

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