spectral_lanczos Module

Uses

Variables

Type	Visibility	Attributes		Name		Initial
real(kind=dp),	public,	allocatable	::	sl_hamil(:,:)
real(kind=dp),	public,	allocatable	::	sl_vecs(:,:)
real(kind=dp),	public,	allocatable	::	full_vec_sl(:)
real(kind=dp),	public,	allocatable	::	full_eigenvecs(:,:)
integer(kind=n_int),	public,	allocatable	::	sl_ilut_list(:,:)
integer(kind=MPIArg),	public,	allocatable	::	ndets_sl(:)
integer(kind=MPIArg),	public,	allocatable	::	disps_sl(:)
integer,	public		::	n_lanc_vecs_sl
real(kind=dp),	public,	allocatable	::	sl_h_eigv(:)
real(kind=dp),	public,	allocatable	::	sl_overlaps(:)

Subroutines

public subroutine perform_spectral_lanczos()

Arguments

None

public subroutine init_spectral_lanczos()

Arguments

None

public subroutine return_perturbed_ground_spec(perturbs, ilut_list, pert_ground_local, all_norm_pert)

Arguments

Type	Intent	Optional	Attributes		Name
type(perturbation),	intent(in),		allocatable	::	perturbs(:)
integer(kind=n_int),	intent(in)			::	ilut_list(:,:)
real(kind=dp),	intent(inout)			::	pert_ground_local(:)
real(kind=dp),	intent(out)			::	all_norm_pert

public subroutine subspace_extraction_sl()

Arguments

None

public subroutine print_sl_eigenvecs()

Arguments

None

public subroutine output_spectrum(neigv, eigv, spec_low, spec_high)

Arguments

Type	Intent	Optional	Attributes		Name
integer,	intent(in)			::	neigv
real(kind=dp),	intent(in)			::	eigv(neigv)
real(kind=dp),	intent(out)			::	spec_low
real(kind=dp),	intent(out)			::	spec_high

public subroutine write_spec_lanc_testsuite_data(h_sum, spec_low, spec_high)

Arguments

Type	Intent	Optional	Attributes		Name
real(kind=dp),	intent(in)			::	h_sum
real(kind=dp),	intent(in)			::	spec_low
real(kind=dp),	intent(in)			::	spec_high

public subroutine end_spectral_lanczos()

Arguments

None