MeanField Class Reference

LibRPA: MeanField Class Reference

LibRPA

Object of the meanfield input of Green's function. More...

#include <meanfield.h>

Public Member Functions
	MeanField (int ns, int nk, int nb, int nao)

void	set (int ns, int nk, int nb, int nao)

	MeanField (const MeanField &)

int	get_n_bands () const

int	get_n_spins () const

int	get_n_kpoints () const

int	get_n_aos () const

double &	get_efermi ()

const double &	get_efermi () const

std::vector< matrix > &	get_eigenvals ()

const std::vector< matrix > &	get_eigenvals () const

std::vector< matrix > &	get_weight ()

const std::vector< matrix > &	get_weight () const

ComplexMatrix	get_dmat_cplx (int ispin, int ikpt) const
	get the density matrix of a particular spin and kpoint

ComplexMatrix	get_dmat_cplx_R (int ispin, const std::vector< Vector3_Order< double >> &kfrac_list, const Vector3_Order< int > &R) const

std::vector< std::vector< ComplexMatrix > > &	get_eigenvectors ()

const std::vector< std::vector< ComplexMatrix > > &	get_eigenvectors () const

double	get_E_min_max (double &emin, double &emax)

double	get_band_gap ()

std::map< double, std::map< Vector3_Order< int >, ComplexMatrix > >	get_gf_cplx_imagtimes_Rs (int ispin, const std::vector< Vector3_Order< double >> &kfrac_list, std::vector< double > imagtimes, const std::vector< Vector3_Order< int >> &Rs) const

std::map< double, std::map< Vector3_Order< int >, matrix > >	get_gf_real_imagtimes_Rs (int ispin, const std::vector< Vector3_Order< double >> &kfrac_list, std::vector< double > imagtimes, const std::vector< Vector3_Order< int >> &Rs) const

void	allredue_wfc_isk ()

Detailed Description

Object of the meanfield input of Green's function.

Note: Energies are saved in Rydberg unit. Currently only n_spins = 1 is implemented.

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