Information on optimization procedure. More...
Collaboration diagram for atom_types::atom_optimization_type:
Private Attributes | |
| REAL(KIND=dp) | damping |
| REAL(KIND=dp) | eps_scf |
| REAL(KIND=dp) | eps_diis |
| INTEGER | max_iter |
| INTEGER | n_diis |
Detailed Description
Information on optimization procedure.
Definition at line 211 of file atom_types.f90.
Member Data Documentation
REAL(KIND=dp) atom_types::atom_optimization_type::damping [private] |
Definition at line 212 of file atom_types.f90.
REAL(KIND=dp) atom_types::atom_optimization_type::eps_diis [private] |
Definition at line 214 of file atom_types.f90.
REAL(KIND=dp) atom_types::atom_optimization_type::eps_scf [private] |
Definition at line 213 of file atom_types.f90.
Definition at line 215 of file atom_types.f90.
Definition at line 216 of file atom_types.f90.
The documentation for this struct was generated from the following file:
