Octopus
target_excited_oct_m Module Reference

Data Types

type  target_excited_t
 Target projecting onto a linear combination of Slater determinants. More...
 

Functions/Subroutines

subroutine target_init_excited (tg, gr, kpoints, namespace, space, ions, qcs, td, w0, oct, ep, restart)
 
subroutine target_output_excited (tg, namespace, space, gr, dir, ions, hm, outp)
 
real(real64) function target_j1_excited (tg, namespace, gr, kpoints, qcpsi, ions)
 
subroutine target_chi_excited (tg, namespace, gr, kpoints, qcpsi_in, qcchi_out, ions)
 

Function/Subroutine Documentation

◆ target_init_excited()

subroutine target_excited_oct_m::target_init_excited ( class(target_excited_t), intent(inout)  tg,
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(oct_t), intent(in)  oct,
type(epot_t), intent(inout)  ep,
type(restart_t), intent(inout)  restart 
)
private

Definition at line 171 of file target_excited.F90.

◆ target_output_excited()

subroutine target_excited_oct_m::target_output_excited ( class(target_excited_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 
)
private

Definition at line 230 of file target_excited.F90.

◆ target_j1_excited()

real(real64) function target_excited_oct_m::target_j1_excited ( class(target_excited_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 
)
private

Definition at line 253 of file target_excited.F90.

◆ target_chi_excited()

subroutine target_excited_oct_m::target_chi_excited ( class(target_excited_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 
)
private

Definition at line 276 of file target_excited.F90.