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Octopus
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Data Types | |
type | cube_function_t |
Functions/Subroutines | |
subroutine, public | dcube_function_alloc_rs (cube, cf, in_device, force_alloc) |
Allocates locally the real space grid, if PFFT library is not used. Otherwise, it assigns the PFFT real space grid to the cube real space grid, via pointer. More... | |
subroutine, public | dcube_function_free_rs (cube, cf) |
Deallocates the real space grid. More... | |
subroutine, public | dcube_function_allgather (cube, cf, cf_local, order, gatherfs) |
subroutine, public | dmesh_to_cube (mesh, mf, cube, cf) |
Convert a function from the mesh to the cube. More... | |
subroutine, public | dcube_to_mesh (cube, cf, mesh, mf) |
Convert a function from the cube to the mesh. More... | |
subroutine, public | dmesh_to_cube_parallel (mesh, mf, cube, cf, map) |
The next two subroutines convert a function between the normal mesh and the cube in parallel. More... | |
subroutine, public | dcube_to_mesh_parallel (cube, cf, mesh, mf, map) |
real(real64) function, public | dcube_function_surface_average (cube, cf) |
This function calculates the surface average of any function. More... | |
subroutine, public | dsubmesh_to_cube (sm, mf, cube, cf) |
The next two subroutines convert a function between a submesh and the cube. More... | |
subroutine, public | dcube_to_submesh (cube, cf, sm, mf) |
subroutine, public | zcube_function_alloc_rs (cube, cf, in_device, force_alloc) |
Allocates locally the real space grid, if PFFT library is not used. Otherwise, it assigns the PFFT real space grid to the cube real space grid, via pointer. More... | |
subroutine, public | zcube_function_free_rs (cube, cf) |
Deallocates the real space grid. More... | |
subroutine, public | zcube_function_allgather (cube, cf, cf_local, order, gatherfs) |
subroutine, public | zmesh_to_cube (mesh, mf, cube, cf) |
Convert a function from the mesh to the cube. More... | |
subroutine, public | zcube_to_mesh (cube, cf, mesh, mf) |
Convert a function from the cube to the mesh. More... | |
subroutine, public | zmesh_to_cube_parallel (mesh, mf, cube, cf, map) |
The next two subroutines convert a function between the normal mesh and the cube in parallel. More... | |
subroutine, public | zcube_to_mesh_parallel (cube, cf, mesh, mf, map) |
complex(real64) function, public | zcube_function_surface_average (cube, cf) |
This function calculates the surface average of any function. More... | |
subroutine, public | zsubmesh_to_cube (sm, mf, cube, cf) |
The next two subroutines convert a function between a submesh and the cube. More... | |
subroutine, public | zcube_to_submesh (cube, cf, sm, mf) |
subroutine, public cube_function_oct_m::dcube_function_alloc_rs | ( | type(cube_t), intent(in), target | cube, |
type(cube_function_t), intent(inout) | cf, | ||
logical, intent(in), optional | in_device, | ||
logical, intent(in), optional | force_alloc | ||
) |
Allocates locally the real space grid, if PFFT library is not used. Otherwise, it assigns the PFFT real space grid to the cube real space grid, via pointer.
Definition at line 248 of file cube_function.F90.
subroutine, public cube_function_oct_m::dcube_function_free_rs | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(inout) | cf | ||
) |
Deallocates the real space grid.
Definition at line 299 of file cube_function.F90.
subroutine, public cube_function_oct_m::dcube_function_allgather | ( | type(cube_t), intent(in) | cube, |
real(real64), dimension(:,:,:), intent(out) | cf, | ||
real(real64), dimension(:,:,:), intent(in), contiguous | cf_local, | ||
integer, dimension(3), intent(in), optional | order, | ||
logical, intent(in), optional | gatherfs | ||
) |
Definition at line 339 of file cube_function.F90.
subroutine, public cube_function_oct_m::dmesh_to_cube | ( | class(mesh_t), intent(in) | mesh, |
real(real64), dimension(:), intent(in), target, contiguous | mf, | ||
type(cube_t), intent(in), target | cube, | ||
type(cube_function_t), intent(inout) | cf | ||
) |
Convert a function from the mesh to the cube.
[in] | mf | function defined on the mesh, meshnp points (local part) |
Definition at line 435 of file cube_function.F90.
subroutine, public cube_function_oct_m::dcube_to_mesh | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(in) | cf, | ||
class(mesh_t), intent(in) | mesh, | ||
real(real64), dimension(:), intent(out), target, contiguous | mf | ||
) |
Convert a function from the cube to the mesh.
[in] | cf | cube function |
[out] | mf | function defined on the mesh, meshnp points (local part) |
Definition at line 636 of file cube_function.F90.
subroutine, public cube_function_oct_m::dmesh_to_cube_parallel | ( | class(mesh_t), intent(in) | mesh, |
real(real64), dimension(:), intent(in), target | mf, | ||
type(cube_t), intent(in) | cube, | ||
type(cube_function_t), intent(inout) | cf, | ||
type(mesh_cube_parallel_map_t), intent(in) | map | ||
) |
The next two subroutines convert a function between the normal mesh and the cube in parallel.
[in] | mf | mf(meshnp) |
Definition at line 713 of file cube_function.F90.
subroutine, public cube_function_oct_m::dcube_to_mesh_parallel | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(in) | cf, | ||
class(mesh_t), intent(in) | mesh, | ||
real(real64), dimension(:), intent(out) | mf, | ||
type(mesh_cube_parallel_map_t), intent(in) | map | ||
) |
[out] | mf | mf(meshnp) |
Definition at line 804 of file cube_function.F90.
real(real64) function, public cube_function_oct_m::dcube_function_surface_average | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(in) | cf | ||
) |
This function calculates the surface average of any function.
Definition at line 879 of file cube_function.F90.
subroutine, public cube_function_oct_m::dsubmesh_to_cube | ( | type(submesh_t), intent(in) | sm, |
real(real64), dimension(:), intent(in), target | mf, | ||
type(cube_t), intent(in) | cube, | ||
type(cube_function_t), intent(inout) | cf | ||
) |
The next two subroutines convert a function between a submesh and the cube.
[in] | mf | function defined on the submesh. |
Definition at line 927 of file cube_function.F90.
subroutine, public cube_function_oct_m::dcube_to_submesh | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(in) | cf, | ||
type(submesh_t), intent(in) | sm, | ||
real(real64), dimension(:), intent(out), target | mf | ||
) |
[out] | mf | function defined on the submesh. |
Definition at line 969 of file cube_function.F90.
subroutine, public cube_function_oct_m::zcube_function_alloc_rs | ( | type(cube_t), intent(in), target | cube, |
type(cube_function_t), intent(inout) | cf, | ||
logical, intent(in), optional | in_device, | ||
logical, intent(in), optional | force_alloc | ||
) |
Allocates locally the real space grid, if PFFT library is not used. Otherwise, it assigns the PFFT real space grid to the cube real space grid, via pointer.
Definition at line 1082 of file cube_function.F90.
subroutine, public cube_function_oct_m::zcube_function_free_rs | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(inout) | cf | ||
) |
Deallocates the real space grid.
Definition at line 1133 of file cube_function.F90.
subroutine, public cube_function_oct_m::zcube_function_allgather | ( | type(cube_t), intent(in) | cube, |
complex(real64), dimension(:,:,:), intent(out) | cf, | ||
complex(real64), dimension(:,:,:), intent(in), contiguous | cf_local, | ||
integer, dimension(3), intent(in), optional | order, | ||
logical, intent(in), optional | gatherfs | ||
) |
Definition at line 1173 of file cube_function.F90.
subroutine, public cube_function_oct_m::zmesh_to_cube | ( | class(mesh_t), intent(in) | mesh, |
complex(real64), dimension(:), intent(in), target, contiguous | mf, | ||
type(cube_t), intent(in), target | cube, | ||
type(cube_function_t), intent(inout) | cf | ||
) |
Convert a function from the mesh to the cube.
[in] | mf | function defined on the mesh, meshnp points (local part) |
Definition at line 1269 of file cube_function.F90.
subroutine, public cube_function_oct_m::zcube_to_mesh | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(in) | cf, | ||
class(mesh_t), intent(in) | mesh, | ||
complex(real64), dimension(:), intent(out), target, contiguous | mf | ||
) |
Convert a function from the cube to the mesh.
[in] | cf | cube function |
[out] | mf | function defined on the mesh, meshnp points (local part) |
Definition at line 1470 of file cube_function.F90.
subroutine, public cube_function_oct_m::zmesh_to_cube_parallel | ( | class(mesh_t), intent(in) | mesh, |
complex(real64), dimension(:), intent(in), target | mf, | ||
type(cube_t), intent(in) | cube, | ||
type(cube_function_t), intent(inout) | cf, | ||
type(mesh_cube_parallel_map_t), intent(in) | map | ||
) |
The next two subroutines convert a function between the normal mesh and the cube in parallel.
[in] | mf | mf(meshnp) |
Definition at line 1547 of file cube_function.F90.
subroutine, public cube_function_oct_m::zcube_to_mesh_parallel | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(in) | cf, | ||
class(mesh_t), intent(in) | mesh, | ||
complex(real64), dimension(:), intent(out) | mf, | ||
type(mesh_cube_parallel_map_t), intent(in) | map | ||
) |
[out] | mf | mf(meshnp) |
Definition at line 1638 of file cube_function.F90.
complex(real64) function, public cube_function_oct_m::zcube_function_surface_average | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(in) | cf | ||
) |
This function calculates the surface average of any function.
Definition at line 1713 of file cube_function.F90.
subroutine, public cube_function_oct_m::zsubmesh_to_cube | ( | type(submesh_t), intent(in) | sm, |
complex(real64), dimension(:), intent(in), target | mf, | ||
type(cube_t), intent(in) | cube, | ||
type(cube_function_t), intent(inout) | cf | ||
) |
The next two subroutines convert a function between a submesh and the cube.
[in] | mf | function defined on the submesh. |
Definition at line 1761 of file cube_function.F90.
subroutine, public cube_function_oct_m::zcube_to_submesh | ( | type(cube_t), intent(in) | cube, |
type(cube_function_t), intent(in) | cf, | ||
type(submesh_t), intent(in) | sm, | ||
complex(real64), dimension(:), intent(out), target | mf | ||
) |
[out] | mf | function defined on the submesh. |
Definition at line 1803 of file cube_function.F90.