Octopus
cube_function_oct_m Module Reference

Data Types

type  cube_function_t
 

Functions/Subroutines

pure logical function cube_map_is_trivial (cube)
 True when the cube_map describes a trivial mesh->cube identity: the mesh is X-fastest with one full-X-row segment per (iy, iz) pair, and the cube has the same dimensions as the mesh. The mapping then degenerates to a flat memcopy. Holds for 3D periodic systems with MeshOrder = order_cube and no domain decomposition. More...
 
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)
 

Function/Subroutine Documentation

◆ cube_map_is_trivial()

pure logical function cube_function_oct_m::cube_map_is_trivial ( type(cube_t), intent(in)  cube)
private

True when the cube_map describes a trivial mesh->cube identity: the mesh is X-fastest with one full-X-row segment per (iy, iz) pair, and the cube has the same dimensions as the mesh. The mapping then degenerates to a flat memcopy. Holds for 3D periodic systems with MeshOrder = order_cube and no domain decomposition.

Definition at line 182 of file cube_function.F90.

◆ dcube_function_alloc_rs()

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 271 of file cube_function.F90.

◆ dcube_function_free_rs()

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 323 of file cube_function.F90.

◆ dcube_function_allgather()

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 363 of file cube_function.F90.

◆ dmesh_to_cube()

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.

Parameters
[in]mffunction defined on the mesh, meshnp points (local part)

Definition at line 390 of file cube_function.F90.

◆ dcube_to_mesh()

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.

Parameters
[in]cfcube function
[out]mffunction defined on the mesh, meshnp points (local part)

Definition at line 605 of file cube_function.F90.

◆ dmesh_to_cube_parallel()

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.

Parameters
[in]mfmf(meshnp)

Definition at line 695 of file cube_function.F90.

◆ dcube_to_mesh_parallel()

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 
)
Parameters
[out]mfmf(meshnp)

Definition at line 786 of file cube_function.F90.

◆ dcube_function_surface_average()

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.

Warning
Some more careful testing should be done on this.

Definition at line 861 of file cube_function.F90.

◆ dsubmesh_to_cube()

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.

Parameters
[in]mffunction defined on the submesh.

Definition at line 912 of file cube_function.F90.

◆ dcube_to_submesh()

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 
)
Parameters
[out]mffunction defined on the submesh.

Definition at line 954 of file cube_function.F90.

◆ zcube_function_alloc_rs()

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 1067 of file cube_function.F90.

◆ zcube_function_free_rs()

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 1119 of file cube_function.F90.

◆ zcube_function_allgather()

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 1159 of file cube_function.F90.

◆ zmesh_to_cube()

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.

Parameters
[in]mffunction defined on the mesh, meshnp points (local part)

Definition at line 1186 of file cube_function.F90.

◆ zcube_to_mesh()

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.

Parameters
[in]cfcube function
[out]mffunction defined on the mesh, meshnp points (local part)

Definition at line 1401 of file cube_function.F90.

◆ zmesh_to_cube_parallel()

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.

Parameters
[in]mfmf(meshnp)

Definition at line 1491 of file cube_function.F90.

◆ zcube_to_mesh_parallel()

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 
)
Parameters
[out]mfmf(meshnp)

Definition at line 1582 of file cube_function.F90.

◆ zcube_function_surface_average()

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.

Warning
Some more careful testing should be done on this.

Definition at line 1657 of file cube_function.F90.

◆ zsubmesh_to_cube()

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.

Parameters
[in]mffunction defined on the submesh.

Definition at line 1708 of file cube_function.F90.

◆ zcube_to_submesh()

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 
)
Parameters
[out]mffunction defined on the submesh.

Definition at line 1750 of file cube_function.F90.