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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 250 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 301 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 341 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 368 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 569 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 646 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 737 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 812 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 860 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 902 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 1015 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 1066 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 1106 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 1133 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 1334 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 1411 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 1502 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 1577 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 1625 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 1667 of file cube_function.F90.