Functions/Subroutines
subroutine, public	eigensolver_evolution (namespace, mesh, st, hm, space, ext_partners, te, iter, niter, converged, tau0, tau, time, propagator, variable_timestep, vks_old, normalization_energies, normalization_energies_prev, residual)

subroutine	exponential_imaginary_time (namespace, mesh, st, hm, te, converged, tau, normalization_energies)

integer function	get_first_unconverged_batch (st, hm, ik, converged)

Function/Subroutine Documentation

◆ eigensolver_evolution()

subroutine, public eigen_evolution_oct_m::eigensolver_evolution	(	type(namespace_t), intent(in)	namespace,
		type(mesh_t), intent(in), target	mesh,
		type(states_elec_t), intent(inout), target	st,
		type(hamiltonian_elec_t), intent(inout), target	hm,
		class(space_t), intent(in)	space,
		type(partner_list_t), intent(in)	ext_partners,
		type(exponential_t), intent(inout)	te,
		integer, intent(in)	iter,
		integer, intent(inout)	niter,
		integer, dimension(:), intent(inout)	converged,
		real(real64), intent(inout)	tau0,
		real(real64), intent(inout)	tau,
		real(real64), intent(inout)	time,
		integer, intent(in)	propagator,
		logical, intent(in)	variable_timestep,
		type(potential_interpolation_t), intent(inout)	vks_old,
		real(real64), dimension(:, :), intent(inout)	normalization_energies,
		real(real64), dimension(:, :), intent(inout)	normalization_energies_prev,
		real(real64), dimension(:, :), intent(inout)	residual
	)

Definition at line 147 of file eigen_evolution.F90.

subroutine eigen_evolution_oct_m::exponential_imaginary_time	(	type(namespace_t), intent(in)	namespace,
		type(mesh_t), intent(in), target	mesh,
		type(states_elec_t), intent(inout), target	st,
		type(hamiltonian_elec_t), intent(inout), target	hm,
		type(exponential_t), intent(inout)	te,
		integer, dimension(:), intent(inout)	converged,
		real(real64), intent(in)	tau,
		real(real64), dimension(:, :), intent(inout)	normalization_energies
	)

private

Parameters

[in,out] converged (1:stnik)

Definition at line 244 of file eigen_evolution.F90.

integer function eigen_evolution_oct_m::get_first_unconverged_batch	(	type(states_elec_t), intent(in)	st,
		type(hamiltonian_elec_t), intent(in)	hm,
		integer, intent(in)	ik,
		integer, dimension(:), intent(in)	converged
	)

private

Definition at line 305 of file eigen_evolution.F90.

integer, parameter, public eigen_evolution_oct_m::it_forward_euler = 1

Definition at line 140 of file eigen_evolution.F90.

integer, parameter, public eigen_evolution_oct_m::it_expmid = 2

Definition at line 140 of file eigen_evolution.F90.