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qs_grid_atom::atom_integration_grid_type Type Reference

Data Fields

integer nr
 
integer na
 
integer np
 
integer ntot
 
integer lebedev_grid
 
real(dp), dimension(:), allocatable rr
 
real(dp), dimension(:), allocatable wr
 
real(dp), dimension(:), allocatable wa
 
integer nbatch
 
type(grid_batch_type), dimension(:), allocatable batch
 

Detailed Description

Definition at line 34 of file qs_grid_atom.F.

Field Documentation

◆ nr

integer qs_grid_atom::atom_integration_grid_type::nr

Definition at line 35 of file qs_grid_atom.F.

◆ na

integer qs_grid_atom::atom_integration_grid_type::na

Definition at line 35 of file qs_grid_atom.F.

◆ np

integer qs_grid_atom::atom_integration_grid_type::np

Definition at line 36 of file qs_grid_atom.F.

◆ ntot

integer qs_grid_atom::atom_integration_grid_type::ntot

Definition at line 36 of file qs_grid_atom.F.

◆ lebedev_grid

integer qs_grid_atom::atom_integration_grid_type::lebedev_grid

Definition at line 37 of file qs_grid_atom.F.

◆ rr

real(dp), dimension(:), allocatable qs_grid_atom::atom_integration_grid_type::rr

Definition at line 38 of file qs_grid_atom.F.

◆ wr

real(dp), dimension(:), allocatable qs_grid_atom::atom_integration_grid_type::wr

Definition at line 39 of file qs_grid_atom.F.

◆ wa

real(dp), dimension(:), allocatable qs_grid_atom::atom_integration_grid_type::wa

Definition at line 39 of file qs_grid_atom.F.

◆ nbatch

integer qs_grid_atom::atom_integration_grid_type::nbatch

Definition at line 40 of file qs_grid_atom.F.

◆ batch

type(grid_batch_type), dimension(:), allocatable qs_grid_atom::atom_integration_grid_type::batch

Definition at line 41 of file qs_grid_atom.F.


The documentation for this type was generated from the following file: