target_oct_m Module Reference

Data Types
type	target_t

Functions/Subroutines
subroutine, public	target_init_propagation (tg)
	This routine performs all the things that must be initialized prior to a forward evolution, regarding the target. Right now some of those initializations are not done here, and should be moved. More...
subroutine, public	target_get_state (tg, st)
	This just copies the states_elec_t variable present in target, into st. More...
subroutine, public	target_init (gr, kpoints, namespace, space, ions, qcs, td, w0, tg, oct, ep, mc)
	The target is initialized, mainly by reading from the inp file. More...
subroutine, public	target_end (tg, oct)
subroutine, public	target_output (tg, namespace, space, gr, dir, ions, hm, outp)
subroutine, public	target_tdcalc (tg, namespace, space, hm, gr, ions, ext_partners, psi, time, max_time)
	Calculates, at a given point in time marked by the integer index, the integrand of the target functional: \( <Psi(t)|\hat{O}(t)|Psi(t)> \). More...
subroutine, public	target_inh (psi, gr, kpoints, tg, time, inh, iter)
	Calculates the inhomogeneous term that appears in the equation for chi, and places it into inh. More...
real(real64) function, public	target_j1 (tg, namespace, gr, kpoints, qcpsi, ions)
	Calculates the J1 functional, i.e.: \( <Psi(T)|\hat{O}|Psi(T)> \) in the time-independent case, or else \( \int_0^T dt <Psi(t)|\hat{O}(t)|Psi(t)> \) in the time-dependent case. More...
subroutine, public	target_chi (tg, namespace, gr, kpoints, qcpsi_in, qcchi_out, ions)
	Calculate \( |chi(T)> = \hat{O}(T) |psi(T)> \). More...
integer pure function, public	target_mode (tg)
integer pure function, public	target_type (tg)
integer pure function, public	target_curr_functional (tg)
logical pure function, public	target_move_ions (tg)
logical pure function	is_spatial_curr_wgt (tg)
subroutine	target_init_density (gr, kpoints, namespace, space, tg, stin, td, restart)
subroutine	target_end_density (tg)
subroutine	target_output_density (tg, namespace, space, mesh, dir, ions, outp)
real(real64) function	target_j1_density (gr, kpoints, tg, psi)
subroutine	target_chi_density (tg, gr, kpoints, psi_in, chi_out)
subroutine	target_tdcalc_density (tg, gr, kpoints, psi, time)
real(real64) function	jcurr_functional (tg, gr, kpoints, psi)
	Calculates a current functional that may be combined with other functionals found in function target_j1. More...
subroutine	chi_current (tg, gr, kpoints, factor, psi_in, chi)
subroutine	target_init_velocity (gr, namespace, ions, tg, oct, td, ep)
subroutine	target_end_velocity (tg, oct)
subroutine	target_output_velocity (tg, namespace, space, gr, dir, ions, hm, outp)
real(real64) function	target_j1_velocity (tg, ions)
subroutine	target_chi_velocity (gr, tg, chi_out, ions)
subroutine	target_tdcalc_velocity (tg, hm, gr, ions, psi, time, max_time)
subroutine	target_init_hhg (tg, namespace, td, w0)
subroutine	target_init_hhgnew (gr, namespace, tg, td, ions, ep)
subroutine	target_end_hhg (tg)
subroutine	target_output_hhg (tg, namespace, space, gr, dir, ions, hm, outp)
subroutine	target_end_hhgnew (tg, oct)
real(real64) function	target_j1_hhg (tg, namespace)
real(real64) function	target_j1_hhgnew (gr, tg)
subroutine	target_chi_hhg (chi_out)
subroutine	target_tdcalc_hhgnew (tg, gr, psi, time, max_time)
subroutine	target_tdcalc_hhg (tg, namespace, space, hm, gr, ions, ext_partners, psi, time)
subroutine	target_init_groundstate (mesh, namespace, space, tg, td, restart, kpoints)
subroutine	target_end_groundstate ()
subroutine	target_output_groundstate (tg, namespace, space, gr, dir, ions, hm, outp)
real(real64) function	target_j1_groundstate (tg, gr, psi)
subroutine	target_chi_groundstate (tg, gr, psi_in, chi_out)
subroutine	target_init_excited (mesh, namespace, space, tg, td, restart, kpoints)
subroutine	target_end_excited ()
subroutine	target_output_excited (tg, namespace, space, gr, dir, ions, hm, outp)
real(real64) function	target_j1_excited (tg, namespace, gr, psi)
subroutine	target_chi_excited (tg, namespace, gr, psi_in, chi_out)
subroutine	target_init_gstransformation (gr, namespace, space, tg, td, restart, kpoints)
subroutine	target_end_gstransformation ()
subroutine	target_output_gstransformation (tg, namespace, space, gr, dir, ions, hm, outp)
real(real64) function	target_j1_gstransformation (tg, gr, psi)
subroutine	target_chi_gstransformation (tg, gr, psi_in, chi_out)
subroutine	target_init_exclude (mesh, namespace, space, tg, td, restart, kpoints)
subroutine	target_end_exclude ()
subroutine	target_output_exclude (tg, namespace, space, gr, dir, ions, hm, outp)
real(real64) function	target_j1_exclude (gr, tg, psi)
subroutine	target_chi_exclude (tg, gr, psi_in, chi_out)
subroutine	target_init_userdefined (gr, namespace, tg, td)
subroutine	target_end_userdefined ()
subroutine	target_output_userdefined (tg, namespace, space, gr, dir, ions, hm, outp)
real(real64) function	target_j1_userdefined (tg, gr, psi)
subroutine	target_chi_userdefined (tg, gr, psi_in, chi_out)
subroutine	target_init_local (gr, namespace, tg, td)
subroutine	target_end_local (tg)
subroutine	target_output_local (tg, namespace, space, mesh, dir, ions, outp)
real(real64) function	target_j1_local (mesh, tg, psi)
subroutine	target_chi_local (tg, mesh, psi_in, chi_out)
subroutine	target_init_tdlocal (gr, namespace, tg, td)
subroutine	target_end_tdlocal (tg)
subroutine	target_output_tdlocal (tg, namespace, space, gr, dir, ions, outp)
real(real64) function	target_j1_tdlocal (tg)
subroutine	target_chi_tdlocal (chi_out)
subroutine	target_tdcalc_tdlocal (tg, gr, psi, time)
subroutine	target_build_tdlocal (tg, gr, time)
subroutine	target_init_classical (ions, namespace, tg, td, oct)
subroutine	target_end_classical (tg)
subroutine	target_output_classical
real(real64) function	target_j1_classical (tg, qcpsi)
subroutine	target_chi_classical (tg, qcpsi, qcchi, ions)
subroutine	target_init_spin (tg, namespace)
real(real64) function	target_j1_spin (tg, gr, psi)
subroutine	target_chi_spin (tg, gr, psi_in, chi_out)

Variables
integer, parameter, public	oct_tg_groundstate = 1
integer, parameter, public	oct_tg_excited = 2
integer, parameter, public	oct_tg_gstransformation = 3
integer, parameter, public	oct_tg_userdefined = 4
integer, parameter, public	oct_tg_jdensity = 5
integer, parameter, public	oct_tg_local = 6
integer, parameter, public	oct_tg_td_local = 7
integer, parameter, public	oct_tg_exclude_state = 8
integer, parameter, public	oct_tg_hhg = 9
integer, parameter, public	oct_tg_velocity = 10
integer, parameter, public	oct_tg_hhgnew = 12
integer, parameter, public	oct_tg_classical = 13
integer, parameter, public	oct_tg_spin = 14
integer, parameter, public	oct_targetmode_static = 0
integer, parameter, public	oct_targetmode_td = 1
integer, parameter, public	oct_no_curr = 0
integer, parameter, public	oct_curr_square = 1
integer, parameter, public	oct_max_curr_ring = 2
integer, parameter, public	oct_curr_square_td = 3

Function/Subroutine Documentation

target_init_propagation()

subroutine, public target_oct_m::target_init_propagation

(

type(target_t), intent(inout)

tg

)

This routine performs all the things that must be initialized prior to a forward evolution, regarding the target. Right now some of those initializations are not done here, and should be moved.

Definition at line 254 of file target.F90.

target_get_state()

subroutine, public target_oct_m::target_get_state	(	type(target_t), intent(in)	tg,
		type(states_elec_t), intent(inout)	st
	)

This just copies the states_elec_t variable present in target, into st.

Definition at line 271 of file target.F90.

target_init()

subroutine, public target_oct_m::target_init	(	type(grid_t), intent(in)	gr,
		type(kpoints_t), intent(in)	kpoints,
		type(namespace_t), intent(in)	namespace,
		class(space_t), intent(in)	space,
		type(ions_t), intent(in)	ions,
		type(opt_control_state_t), intent(inout)	qcs,
		type(td_t), intent(in)	td,
		real(real64), intent(in)	w0,
		type(target_t), intent(inout)	tg,
		type(oct_t), intent(in)	oct,
		type(epot_t), intent(inout)	ep,
		type(multicomm_t), intent(in)	mc
	)

The target is initialized, mainly by reading from the inp file.

Definition at line 285 of file target.F90.

target_end()

subroutine, public target_oct_m::target_end	(	type(target_t), intent(inout)	tg,
		type(oct_t), intent(in)	oct
	)

Definition at line 431 of file target.F90.

target_output()

subroutine, public target_oct_m::target_output	(	type(target_t), intent(inout)	tg,
		type(namespace_t), intent(in)	namespace,
		class(space_t), intent(in)	space,
		type(grid_t), intent(in)	gr,
		character(len=*), intent(in)	dir,
		type(ions_t), intent(in)	ions,
		type(hamiltonian_elec_t), intent(in)	hm,
		type(output_t), intent(in)	outp
	)

Definition at line 472 of file target.F90.

target_tdcalc()

subroutine, public target_oct_m::target_tdcalc	(	type(target_t), intent(inout)	tg,
		type(namespace_t), intent(in)	namespace,
		class(space_t), intent(in)	space,
		type(hamiltonian_elec_t), intent(inout)	hm,
		type(grid_t), intent(in)	gr,
		type(ions_t), intent(inout)	ions,
		type(partner_list_t), intent(in)	ext_partners,
		type(states_elec_t), intent(inout)	psi,
		integer, intent(in)	time,
		integer, intent(in)	max_time
	)

Calculates, at a given point in time marked by the integer index, the integrand of the target functional: \( <Psi(t)|\hat{O}(t)|Psi(t)> \).

Definition at line 520 of file target.F90.

target_inh()

subroutine, public target_oct_m::target_inh	(	type(states_elec_t), intent(inout)	psi,
		type(grid_t), intent(in)	gr,
		type(kpoints_t), intent(in)	kpoints,
		type(target_t), intent(inout)	tg,
		real(real64), intent(in)	time,
		type(states_elec_t), intent(inout)	inh,
		integer, intent(in)	iter
	)

Calculates the inhomogeneous term that appears in the equation for chi, and places it into inh.

Definition at line 563 of file target.F90.

target_j1()

real(real64) function, public target_oct_m::target_j1	(	type(target_t), intent(inout)	tg,
		type(namespace_t), intent(in)	namespace,
		type(grid_t), intent(in)	gr,
		type(kpoints_t), intent(in)	kpoints,
		type(opt_control_state_t), intent(inout)	qcpsi,
		type(ions_t), intent(in), optional	ions
	)

Calculates the J1 functional, i.e.: \( <Psi(T)|\hat{O}|Psi(T)> \) in the time-independent case, or else \( \int_0^T dt <Psi(t)|\hat{O}(t)|Psi(t)> \) in the time-dependent case.

Definition at line 654 of file target.F90.

target_chi()

subroutine, public target_oct_m::target_chi	(	type(target_t), intent(inout)	tg,
		type(namespace_t), intent(in)	namespace,
		type(grid_t), intent(in)	gr,
		type(kpoints_t), intent(in)	kpoints,
		type(opt_control_state_t), intent(inout), target	qcpsi_in,
		type(opt_control_state_t), intent(inout), target	qcchi_out,
		type(ions_t), intent(in)	ions
	)

Calculate \( |chi(T)> = \hat{O}(T) |psi(T)> \).

Definition at line 706 of file target.F90.

target_mode()

integer pure function, public target_oct_m::target_mode

(

type(target_t), intent(in)

tg

)

Definition at line 769 of file target.F90.

target_type()

integer pure function, public target_oct_m::target_type

(

type(target_t), intent(in)

tg

)

Definition at line 791 of file target.F90.

target_curr_functional()

integer pure function, public target_oct_m::target_curr_functional

(

type(target_t), intent(in)

tg

)

Definition at line 799 of file target.F90.

target_move_ions()

logical pure function, public target_oct_m::target_move_ions

(

type(target_t), intent(in)

tg

)

Definition at line 807 of file target.F90.

is_spatial_curr_wgt()

logical pure function target_oct_m::is_spatial_curr_wgt ( type(target_t), intent(in)  tg )

private

Definition at line 814 of file target.F90.

target_init_density()

subroutine target_oct_m::target_init_density ( type(grid_t), intent(in)  gr, type(kpoints_t), intent(in)  kpoints, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(target_t), intent(inout)  tg, type(states_elec_t), intent(inout)  stin, type(td_t), intent(in)  td, type(restart_t), intent(inout)  restart  )

private

Definition at line 843 of file target.F90.

target_end_density()

subroutine target_oct_m::target_end_density ( type(target_t), intent(inout)  tg )

private

Definition at line 1145 of file target.F90.

target_output_density()

subroutine target_oct_m::target_output_density ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, class(mesh_t), intent(in)  mesh, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(output_t), intent(in)  outp  )

private

Definition at line 1162 of file target.F90.

target_j1_density()

real(real64) function target_oct_m::target_j1_density ( type(grid_t), intent(in)  gr, type(kpoints_t), intent(in)  kpoints, type(target_t), intent(in)  tg, type(states_elec_t), intent(inout)  psi  )

private

Definition at line 1189 of file target.F90.

target_chi_density()

subroutine target_oct_m::target_chi_density ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(kpoints_t), intent(in)  kpoints, type(states_elec_t), intent(inout)  psi_in, type(states_elec_t), intent(inout)  chi_out  )

private

Definition at line 1238 of file target.F90.

target_tdcalc_density()

subroutine target_oct_m::target_tdcalc_density ( type(target_t), intent(inout)  tg, type(grid_t), intent(in)  gr, type(kpoints_t), intent(in)  kpoints, type(states_elec_t), intent(inout)  psi, integer, intent(in)  time  )

private

Definition at line 1317 of file target.F90.

jcurr_functional()

real(real64) function target_oct_m::jcurr_functional ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(kpoints_t), intent(in)  kpoints, type(states_elec_t), intent(inout)  psi  )

private

Calculates a current functional that may be combined with other functionals found in function target_j1.

Definition at line 1339 of file target.F90.

chi_current()

subroutine target_oct_m::chi_current ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(kpoints_t), intent(in)  kpoints, real(real64), intent(in)  factor, type(states_elec_t), intent(inout)  psi_in, type(states_elec_t), intent(inout)  chi  )

private

Definition at line 1400 of file target.F90.

target_init_velocity()

subroutine target_oct_m::target_init_velocity ( type(grid_t), intent(in)  gr, type(namespace_t), intent(in)  namespace, type(ions_t), intent(in)  ions, type(target_t), intent(inout)  tg, type(oct_t), intent(in)  oct, type(td_t), intent(in)  td, type(epot_t), intent(in)  ep  )

private

Definition at line 1538 of file target.F90.

target_end_velocity()

subroutine target_oct_m::target_end_velocity ( type(target_t), intent(inout)  tg, type(oct_t), intent(in)  oct  )

private

Definition at line 1680 of file target.F90.

target_output_velocity()

subroutine target_oct_m::target_output_velocity ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(grid_t), intent(in)  gr, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(hamiltonian_elec_t), intent(in)  hm, type(output_t), intent(in)  outp  )

private

Definition at line 1698 of file target.F90.

target_j1_velocity()

real(real64) function target_oct_m::target_j1_velocity ( type(target_t), intent(in)  tg, type(ions_t), intent(in)  ions  )

private

Definition at line 1720 of file target.F90.

target_chi_velocity()

subroutine target_oct_m::target_chi_velocity ( type(grid_t), intent(in)  gr, type(target_t), intent(inout)  tg, type(states_elec_t), intent(inout)  chi_out, type(ions_t), intent(in)  ions  )

private

Definition at line 1750 of file target.F90.

target_tdcalc_velocity()

subroutine target_oct_m::target_tdcalc_velocity ( type(target_t), intent(inout)  tg, type(hamiltonian_elec_t), intent(in)  hm, type(grid_t), intent(in)  gr, type(ions_t), intent(inout)  ions, type(states_elec_t), intent(in)  psi, integer, intent(in)  time, integer, intent(in)  max_time  )

private

Definition at line 1796 of file target.F90.

target_init_hhg()

subroutine target_oct_m::target_init_hhg ( type(target_t), intent(inout)  tg, type(namespace_t), intent(in)  namespace, type(td_t), intent(in)  td, real(real64), intent(in)  w0  )

private

Definition at line 1870 of file target.F90.

target_init_hhgnew()

subroutine target_oct_m::target_init_hhgnew ( type(grid_t), intent(in)  gr, type(namespace_t), intent(in)  namespace, type(target_t), intent(inout)  tg, type(td_t), intent(in)  td, type(ions_t), intent(in)  ions, type(epot_t), intent(in)  ep  )

private

Definition at line 1949 of file target.F90.

target_end_hhg()

subroutine target_oct_m::target_end_hhg ( type(target_t), intent(inout)  tg )

private

Definition at line 2045 of file target.F90.

target_output_hhg()

subroutine target_oct_m::target_output_hhg ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(grid_t), intent(in)  gr, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(hamiltonian_elec_t), intent(in)  hm, type(output_t), intent(in)  outp  )

private

Definition at line 2060 of file target.F90.

target_end_hhgnew()

subroutine target_oct_m::target_end_hhgnew ( type(target_t), intent(inout)  tg, type(oct_t), intent(in)  oct  )

private

Definition at line 2082 of file target.F90.

target_j1_hhg()

real(real64) function target_oct_m::target_j1_hhg ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace  )

private

Definition at line 2105 of file target.F90.

target_j1_hhgnew()

real(real64) function target_oct_m::target_j1_hhgnew ( type(grid_t), intent(in)  gr, type(target_t), intent(in)  tg  )

private

Definition at line 2137 of file target.F90.

target_chi_hhg()

subroutine target_oct_m::target_chi_hhg ( type(states_elec_t), intent(inout)  chi_out )

private

Definition at line 2159 of file target.F90.

target_tdcalc_hhgnew()

subroutine target_oct_m::target_tdcalc_hhgnew ( type(target_t), intent(inout)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi, integer, intent(in)  time, integer, intent(in)  max_time  )

private

Definition at line 2179 of file target.F90.

target_tdcalc_hhg()

subroutine target_oct_m::target_tdcalc_hhg ( type(target_t), intent(inout)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(hamiltonian_elec_t), intent(in)  hm, type(grid_t), intent(in)  gr, type(ions_t), intent(inout)  ions, type(partner_list_t), intent(in)  ext_partners, type(states_elec_t), intent(in)  psi, integer, intent(in)  time  )

private

Definition at line 2247 of file target.F90.

target_init_groundstate()

subroutine target_oct_m::target_init_groundstate ( class(mesh_t), intent(in)  mesh, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(target_t), intent(inout)  tg, type(td_t), intent(in)  td, type(restart_t), intent(in)  restart, type(kpoints_t), intent(in)  kpoints  )

private

Definition at line 2298 of file target.F90.

target_end_groundstate()

subroutine target_oct_m::target_end_groundstate

private

Definition at line 2329 of file target.F90.

target_output_groundstate()

subroutine target_oct_m::target_output_groundstate ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(grid_t), intent(in)  gr, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(hamiltonian_elec_t), intent(in)  hm, type(output_t), intent(in)  outp  )

private

Definition at line 2337 of file target.F90.

target_j1_groundstate()

real(real64) function target_oct_m::target_j1_groundstate ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi  )

private

Definition at line 2359 of file target.F90.

target_chi_groundstate()

subroutine target_oct_m::target_chi_groundstate ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi_in, type(states_elec_t), intent(inout)  chi_out  )

private

Definition at line 2393 of file target.F90.

target_init_excited()

subroutine target_oct_m::target_init_excited ( class(mesh_t), intent(in)  mesh, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(target_t), intent(inout)  tg, type(td_t), intent(in)  td, type(restart_t), intent(in)  restart, type(kpoints_t), intent(in)  kpoints  )

private

Definition at line 2458 of file target.F90.

target_end_excited()

subroutine target_oct_m::target_end_excited

private

Definition at line 2513 of file target.F90.

target_output_excited()

subroutine target_oct_m::target_output_excited ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(grid_t), intent(in)  gr, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(hamiltonian_elec_t), intent(in)  hm, type(output_t), intent(in)  outp  )

private

Definition at line 2521 of file target.F90.

target_j1_excited()

real(real64) function target_oct_m::target_j1_excited ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi  )

private

Definition at line 2544 of file target.F90.

target_chi_excited()

subroutine target_oct_m::target_chi_excited ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi_in, type(states_elec_t), intent(inout)  chi_out  )

private

Definition at line 2560 of file target.F90.

target_init_gstransformation()

subroutine target_oct_m::target_init_gstransformation ( type(grid_t), intent(in)  gr, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(target_t), intent(inout)  tg, type(td_t), intent(in)  td, type(restart_t), intent(inout)  restart, type(kpoints_t), intent(in)  kpoints  )

private

Definition at line 2722 of file target.F90.

target_end_gstransformation()

subroutine target_oct_m::target_end_gstransformation

private

Definition at line 2766 of file target.F90.

target_output_gstransformation()

subroutine target_oct_m::target_output_gstransformation ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(grid_t), intent(in)  gr, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(hamiltonian_elec_t), intent(in)  hm, type(output_t), intent(in)  outp  )

private

Definition at line 2775 of file target.F90.

target_j1_gstransformation()

real(real64) function target_oct_m::target_j1_gstransformation ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi  )

private

Definition at line 2797 of file target.F90.

target_chi_gstransformation()

subroutine target_oct_m::target_chi_gstransformation ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi_in, type(states_elec_t), intent(inout)  chi_out  )

private

Definition at line 2832 of file target.F90.

target_init_exclude()

subroutine target_oct_m::target_init_exclude ( class(mesh_t), intent(in)  mesh, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(target_t), intent(inout)  tg, type(td_t), intent(in)  td, type(restart_t), intent(inout)  restart, type(kpoints_t), intent(in)  kpoints  )

private

Definition at line 2896 of file target.F90.

target_end_exclude()

subroutine target_oct_m::target_end_exclude

private

Definition at line 2934 of file target.F90.

target_output_exclude()

subroutine target_oct_m::target_output_exclude ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(grid_t), intent(in)  gr, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(hamiltonian_elec_t), intent(in)  hm, type(output_t), intent(in)  outp  )

private

Definition at line 2942 of file target.F90.

target_j1_exclude()

real(real64) function target_oct_m::target_j1_exclude ( type(grid_t), intent(in)  gr, type(target_t), intent(in)  tg, type(states_elec_t), intent(in)  psi  )

private

Definition at line 2964 of file target.F90.

target_chi_exclude()

subroutine target_oct_m::target_chi_exclude ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi_in, type(states_elec_t), intent(inout)  chi_out  )

private

Definition at line 2996 of file target.F90.

target_init_userdefined()

subroutine target_oct_m::target_init_userdefined ( type(grid_t), intent(in)  gr, type(namespace_t), intent(in)  namespace, type(target_t), intent(inout)  tg, type(td_t), intent(in)  td  )

private

Definition at line 3062 of file target.F90.

target_end_userdefined()

subroutine target_oct_m::target_end_userdefined

private

Definition at line 3152 of file target.F90.

target_output_userdefined()

subroutine target_oct_m::target_output_userdefined ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(grid_t), intent(in)  gr, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(hamiltonian_elec_t), intent(in)  hm, type(output_t), intent(in)  outp  )

private

Definition at line 3160 of file target.F90.

target_j1_userdefined()

real(real64) function target_oct_m::target_j1_userdefined ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi  )

private

Definition at line 3181 of file target.F90.

target_chi_userdefined()

subroutine target_oct_m::target_chi_userdefined ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi_in, type(states_elec_t), intent(inout)  chi_out  )

private

Definition at line 3214 of file target.F90.

target_init_local()

subroutine target_oct_m::target_init_local ( type(grid_t), intent(in)  gr, type(namespace_t), intent(in)  namespace, type(target_t), intent(inout)  tg, type(td_t), intent(in)  td  )

private

Definition at line 3278 of file target.F90.

target_end_local()

subroutine target_oct_m::target_end_local ( type(target_t), intent(inout)  tg )

private

Definition at line 3323 of file target.F90.

target_output_local()

subroutine target_oct_m::target_output_local ( type(target_t), intent(in)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, class(mesh_t), intent(in)  mesh, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(output_t), intent(in)  outp  )

private

Definition at line 3335 of file target.F90.

target_j1_local()

real(real64) function target_oct_m::target_j1_local ( class(mesh_t), intent(in)  mesh, type(target_t), intent(in)  tg, type(states_elec_t), intent(in)  psi  )

private

Definition at line 3359 of file target.F90.

target_chi_local()

subroutine target_oct_m::target_chi_local ( type(target_t), intent(in)  tg, class(mesh_t), intent(in)  mesh, type(states_elec_t), intent(in)  psi_in, type(states_elec_t), intent(inout)  chi_out  )

private

Definition at line 3378 of file target.F90.

target_init_tdlocal()

subroutine target_oct_m::target_init_tdlocal ( type(grid_t), intent(in)  gr, type(namespace_t), intent(in)  namespace, type(target_t), intent(inout)  tg, type(td_t), intent(in)  td  )

private

Definition at line 3437 of file target.F90.

target_end_tdlocal()

subroutine target_oct_m::target_end_tdlocal ( type(target_t), intent(inout)  tg )

private

Definition at line 3477 of file target.F90.

target_output_tdlocal()

subroutine target_oct_m::target_output_tdlocal ( type(target_t), intent(inout)  tg, type(namespace_t), intent(in)  namespace, class(space_t), intent(in)  space, type(grid_t), intent(in)  gr, character(len=*), intent(in)  dir, type(ions_t), intent(in)  ions, type(output_t), intent(in)  outp  )

private

Definition at line 3490 of file target.F90.

target_j1_tdlocal()

real(real64) function target_oct_m::target_j1_tdlocal ( type(target_t), intent(in)  tg )

private

Definition at line 3514 of file target.F90.

target_chi_tdlocal()

subroutine target_oct_m::target_chi_tdlocal ( type(states_elec_t), intent(inout)  chi_out )

private

Definition at line 3532 of file target.F90.

target_tdcalc_tdlocal()

subroutine target_oct_m::target_tdcalc_tdlocal ( type(target_t), intent(inout)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi, integer, intent(in)  time  )

private

Definition at line 3553 of file target.F90.

target_build_tdlocal()

subroutine target_oct_m::target_build_tdlocal ( type(target_t), intent(inout)  tg, type(grid_t), intent(in)  gr, real(real64), intent(in)  time  )

private

Definition at line 3601 of file target.F90.

target_init_classical()

subroutine target_oct_m::target_init_classical ( type(ions_t), intent(in)  ions, type(namespace_t), intent(in)  namespace, type(target_t), intent(inout)  tg, type(td_t), intent(in)  td, type(oct_t), intent(in)  oct  )

private

Definition at line 3649 of file target.F90.

target_end_classical()

subroutine target_oct_m::target_end_classical ( type(target_t), intent(inout)  tg )

private

Definition at line 3749 of file target.F90.

target_output_classical()

subroutine target_oct_m::target_output_classical

private

Definition at line 3763 of file target.F90.

target_j1_classical()

real(real64) function target_oct_m::target_j1_classical ( type(target_t), intent(inout)  tg, type(opt_control_state_t), intent(in)  qcpsi  )

private

Definition at line 3772 of file target.F90.

target_chi_classical()

subroutine target_oct_m::target_chi_classical ( type(target_t), intent(inout)  tg, type(opt_control_state_t), intent(inout)  qcpsi, type(opt_control_state_t), intent(inout)  qcchi, type(ions_t), intent(in)  ions  )

private

Definition at line 3799 of file target.F90.

target_init_spin()

subroutine target_oct_m::target_init_spin ( type(target_t), intent(inout)  tg, type(namespace_t), intent(in)  namespace  )

private

Definition at line 3887 of file target.F90.

target_j1_spin()

real(real64) function target_oct_m::target_j1_spin ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi  )

private

Definition at line 3941 of file target.F90.

target_chi_spin()

subroutine target_oct_m::target_chi_spin ( type(target_t), intent(in)  tg, type(grid_t), intent(in)  gr, type(states_elec_t), intent(in)  psi_in, type(states_elec_t), intent(inout)  chi_out  )

private

Definition at line 3971 of file target.F90.

Variable Documentation

oct_tg_groundstate

integer, parameter, public target_oct_m::oct_tg_groundstate = 1

Definition at line 186 of file target.F90.

oct_tg_excited

integer, parameter, public target_oct_m::oct_tg_excited = 2

Definition at line 186 of file target.F90.

oct_tg_gstransformation

integer, parameter, public target_oct_m::oct_tg_gstransformation = 3

Definition at line 186 of file target.F90.

oct_tg_userdefined

integer, parameter, public target_oct_m::oct_tg_userdefined = 4

Definition at line 186 of file target.F90.

oct_tg_jdensity

integer, parameter, public target_oct_m::oct_tg_jdensity = 5

Definition at line 186 of file target.F90.

oct_tg_local

integer, parameter, public target_oct_m::oct_tg_local = 6

Definition at line 186 of file target.F90.

oct_tg_td_local

integer, parameter, public target_oct_m::oct_tg_td_local = 7

Definition at line 186 of file target.F90.

oct_tg_exclude_state

integer, parameter, public target_oct_m::oct_tg_exclude_state = 8

Definition at line 186 of file target.F90.

oct_tg_hhg

integer, parameter, public target_oct_m::oct_tg_hhg = 9

Definition at line 186 of file target.F90.

oct_tg_velocity

integer, parameter, public target_oct_m::oct_tg_velocity = 10

Definition at line 186 of file target.F90.

oct_tg_hhgnew

integer, parameter, public target_oct_m::oct_tg_hhgnew = 12

Definition at line 186 of file target.F90.

oct_tg_classical

integer, parameter, public target_oct_m::oct_tg_classical = 13

Definition at line 186 of file target.F90.

oct_tg_spin

integer, parameter, public target_oct_m::oct_tg_spin = 14

Definition at line 186 of file target.F90.

oct_targetmode_static

integer, parameter, public target_oct_m::oct_targetmode_static = 0

Definition at line 201 of file target.F90.

oct_targetmode_td

integer, parameter, public target_oct_m::oct_targetmode_td = 1

Definition at line 201 of file target.F90.

oct_no_curr

integer, parameter, public target_oct_m::oct_no_curr = 0

Definition at line 205 of file target.F90.

oct_curr_square

integer, parameter, public target_oct_m::oct_curr_square = 1

Definition at line 205 of file target.F90.

oct_max_curr_ring

integer, parameter, public target_oct_m::oct_max_curr_ring = 2

Definition at line 205 of file target.F90.

oct_curr_square_td

integer, parameter, public target_oct_m::oct_curr_square_td = 3

Definition at line 205 of file target.F90.