Provides all information about a basis set. More...
Collaboration diagram for atom_types::atom_basis_type:
Private Attributes | |
| INTEGER | basis_type |
| INTEGER, dimension(0:3) | nbas |
| INTEGER, dimension(0:3) | nprim |
| REAL(KIND=dp), dimension(:,:), pointer | am |
| REAL(KIND=dp), dimension(:,:,:), pointer | cm |
| REAL(KIND=dp), dimension(:,:), pointer | as |
| INTEGER, dimension(:,:), pointer | ns |
| REAL(KIND=dp), dimension(:,:,:), pointer | bf |
| REAL(KIND=dp), dimension(:,:,:), pointer | dbf |
| REAL(KIND=dp) | eps_eig |
| TYPE(grid_atom_type), pointer | grid |
| LOGICAL | geometrical |
| REAL(KIND=dp) | aval |
| REAL(KIND=dp) | cval |
| INTEGER, dimension(0:3) | start |
Detailed Description
Provides all information about a basis set.
Definition at line 65 of file atom_types.f90.
Member Data Documentation
REAL(KIND=dp),dimension(:,:),pointer atom_types::atom_basis_type::am [private] |
Definition at line 69 of file atom_types.f90.
REAL(KIND=dp),dimension(:,:),pointer atom_types::atom_basis_type::as [private] |
Definition at line 71 of file atom_types.f90.
REAL(KIND=dp) atom_types::atom_basis_type::aval [private] |
Definition at line 78 of file atom_types.f90.
Definition at line 66 of file atom_types.f90.
REAL(KIND=dp),dimension(:,:,:),pointer atom_types::atom_basis_type::bf [private] |
Definition at line 73 of file atom_types.f90.
REAL(KIND=dp),dimension(:,:,:),pointer atom_types::atom_basis_type::cm [private] |
Definition at line 70 of file atom_types.f90.
REAL(KIND=dp) atom_types::atom_basis_type::cval [private] |
Definition at line 78 of file atom_types.f90.
REAL(KIND=dp),dimension(:,:,:),pointer atom_types::atom_basis_type::dbf [private] |
Definition at line 74 of file atom_types.f90.
REAL(KIND=dp) atom_types::atom_basis_type::eps_eig [private] |
Definition at line 75 of file atom_types.f90.
LOGICAL atom_types::atom_basis_type::geometrical [private] |
Definition at line 77 of file atom_types.f90.
TYPE(grid_atom_type),pointer atom_types::atom_basis_type::grid [private] |
Definition at line 76 of file atom_types.f90.
INTEGER,dimension(0:3) atom_types::atom_basis_type::nbas [private] |
Definition at line 67 of file atom_types.f90.
INTEGER,dimension(0:3) atom_types::atom_basis_type::nprim [private] |
Definition at line 68 of file atom_types.f90.
INTEGER,dimension(:,:),pointer atom_types::atom_basis_type::ns [private] |
Definition at line 72 of file atom_types.f90.
INTEGER,dimension(0:3) atom_types::atom_basis_type::start [private] |
Definition at line 79 of file atom_types.f90.
The documentation for this struct was generated from the following file:
