Octopus
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Data Types | |
type | propagation_ops_elec_t |
Functions/Subroutines | |
subroutine, public | propagation_ops_elec_update_hamiltonian (namespace, space, st, mesh, hm, ext_partners, time) |
subroutine, public | propagation_ops_elec_move_ions (wo, gr, hm, st, namespace, space, ions_dyn, ions, ext_partners, time, dt, save_pos) |
subroutine, public | propagation_ops_elec_restore_ions (wo, ions_dyn, ions) |
subroutine, public | propagation_ops_elec_propagate_gauge_field (wo, gfield, dt, time, save_gf) |
subroutine, public | propagation_ops_elec_restore_gauge_field (wo, namespace, space, hm, mesh, ext_partners) |
subroutine, public | propagation_ops_elec_exp_apply (te, namespace, st, mesh, hm, dt) |
subroutine, public | propagation_ops_elec_fuse_density_exp_apply (te, namespace, st, gr, hm, dt, dt2, vmagnus) |
subroutine, public | propagation_ops_do_pack (st, hm, ib, ik) |
subroutine, public | propagation_ops_do_unpack (st, hm, ib, ik) |
subroutine, public | propagation_ops_finish_unpack (st, hm, ib, ik) |
subroutine, public | propagation_ops_elec_interpolate_get (mesh, hm, interp) |
subroutine | calculate_mxll_dipole_field (hm, mesh, st) |
subroutine, public propagation_ops_elec_oct_m::propagation_ops_elec_update_hamiltonian | ( | type(namespace_t), intent(in) | namespace, |
class(space_t), intent(in) | space, | ||
type(states_elec_t), intent(inout) | st, | ||
class(mesh_t), intent(in) | mesh, | ||
type(hamiltonian_elec_t), intent(inout) | hm, | ||
type(partner_list_t), intent(in) | ext_partners, | ||
real(real64), intent(in) | time | ||
) |
Definition at line 174 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_elec_move_ions | ( | class(propagation_ops_elec_t), intent(inout) | wo, |
type(grid_t), intent(in) | gr, | ||
type(hamiltonian_elec_t), intent(inout) | hm, | ||
type(states_elec_t), intent(inout) | st, | ||
type(namespace_t), intent(in) | namespace, | ||
type(electron_space_t), intent(in) | space, | ||
type(ion_dynamics_t), intent(inout) | ions_dyn, | ||
type(ions_t), intent(inout) | ions, | ||
type(partner_list_t), intent(in) | ext_partners, | ||
real(real64), intent(in) | time, | ||
real(real64), intent(in) | dt, | ||
logical, intent(in), optional | save_pos | ||
) |
Definition at line 199 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_elec_restore_ions | ( | class(propagation_ops_elec_t), intent(inout) | wo, |
type(ion_dynamics_t), intent(inout) | ions_dyn, | ||
type(ions_t), intent(inout) | ions | ||
) |
Definition at line 236 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_elec_propagate_gauge_field | ( | class(propagation_ops_elec_t), intent(inout) | wo, |
type(gauge_field_t), intent(inout) | gfield, | ||
real(real64), intent(in) | dt, | ||
real(real64), intent(in) | time, | ||
logical, intent(in), optional | save_gf | ||
) |
Definition at line 256 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_elec_restore_gauge_field | ( | class(propagation_ops_elec_t), intent(inout) | wo, |
type(namespace_t), intent(in) | namespace, | ||
class(space_t), intent(in) | space, | ||
type(hamiltonian_elec_t), intent(inout) | hm, | ||
class(mesh_t), intent(in) | mesh, | ||
type(partner_list_t), intent(in) | ext_partners | ||
) |
Definition at line 284 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_elec_exp_apply | ( | type(exponential_t), intent(inout) | te, |
type(namespace_t), intent(in) | namespace, | ||
type(states_elec_t), intent(inout) | st, | ||
class(mesh_t), intent(in) | mesh, | ||
type(hamiltonian_elec_t), intent(inout) | hm, | ||
real(real64), intent(in) | dt | ||
) |
Definition at line 313 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_elec_fuse_density_exp_apply | ( | type(exponential_t), intent(inout) | te, |
type(namespace_t), intent(in) | namespace, | ||
type(states_elec_t), intent(inout) | st, | ||
type(grid_t), intent(in) | gr, | ||
type(hamiltonian_elec_t), intent(inout) | hm, | ||
real(real64), intent(in) | dt, | ||
real(real64), intent(in), optional | dt2, | ||
real(real64), dimension(:,:,:), intent(in), optional | vmagnus | ||
) |
Definition at line 357 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_do_pack | ( | type(states_elec_t), intent(inout) | st, |
type(hamiltonian_elec_t), intent(inout) | hm, | ||
integer, intent(in) | ib, | ||
integer, intent(in) | ik | ||
) |
Definition at line 432 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_do_unpack | ( | type(states_elec_t), intent(inout) | st, |
type(hamiltonian_elec_t), intent(inout) | hm, | ||
integer, intent(in) | ib, | ||
integer, intent(in) | ik | ||
) |
Definition at line 448 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_finish_unpack | ( | type(states_elec_t), intent(inout) | st, |
type(hamiltonian_elec_t), intent(inout) | hm, | ||
integer, intent(in) | ib, | ||
integer, intent(in) | ik | ||
) |
Definition at line 464 of file propagation_ops_elec.F90.
subroutine, public propagation_ops_elec_oct_m::propagation_ops_elec_interpolate_get | ( | class(mesh_t), intent(in) | mesh, |
type(hamiltonian_elec_t), intent(inout) | hm, | ||
type(potential_interpolation_t), intent(inout) | interp | ||
) |
Definition at line 480 of file propagation_ops_elec.F90.
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private |
Definition at line 494 of file propagation_ops_elec.F90.