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CP2K 2.4 (Revision 12889)
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Collaboration diagram for gopt_param_types::gopt_param_type:Private Attributes | |
| LOGICAL | Fletcher_Reeves |
| INTEGER | id_nr |
| INTEGER | ref_count |
| INTEGER | method_id |
| INTEGER | type_id |
| INTEGER | ts_method_id |
| INTEGER | cell_method_id |
| INTEGER | shellcore_method_id |
| INTEGER | max_f_per_iter |
| INTEGER | max_iter |
| INTEGER | max_h_rank |
| INTEGER | max_steep_steps |
| REAL(KIND=dp) | restart_limit |
| REAL(KIND=dp) | wanted_proj_gradient |
| REAL(KIND=dp) | wanted_rel_f_error |
| REAL(KIND=dp) | max_dr |
| REAL(KIND=dp) | max_force |
| REAL(KIND=dp) | rms_dr |
| REAL(KIND=dp) | rms_force |
| REAL(KIND=dp) | dimer_angle_tol |
| TYPE(cg_ls_param_type) | cg_ls |
Definition at line 56 of file gopt_param_types.f90.
Definition at line 60 of file gopt_param_types.f90.
TYPE(cg_ls_param_type) gopt_param_types::gopt_param_type::cg_ls [private] |
Definition at line 67 of file gopt_param_types.f90.
REAL(KIND = dp) gopt_param_types::gopt_param_type::dimer_angle_tol [private] |
Definition at line 66 of file gopt_param_types.f90.
LOGICAL gopt_param_types::gopt_param_type::Fletcher_Reeves [private] |
Definition at line 57 of file gopt_param_types.f90.
Definition at line 58 of file gopt_param_types.f90.
REAL(KIND = dp) gopt_param_types::gopt_param_type::max_dr [private] |
Definition at line 65 of file gopt_param_types.f90.
Definition at line 61 of file gopt_param_types.f90.
REAL(KIND = dp) gopt_param_types::gopt_param_type::max_force [private] |
Definition at line 65 of file gopt_param_types.f90.
Definition at line 61 of file gopt_param_types.f90.
Definition at line 61 of file gopt_param_types.f90.
Definition at line 62 of file gopt_param_types.f90.
Definition at line 59 of file gopt_param_types.f90.
Definition at line 58 of file gopt_param_types.f90.
REAL(KIND = dp) gopt_param_types::gopt_param_type::restart_limit [private] |
Definition at line 63 of file gopt_param_types.f90.
REAL(KIND = dp) gopt_param_types::gopt_param_type::rms_dr [private] |
Definition at line 65 of file gopt_param_types.f90.
REAL(KIND = dp) gopt_param_types::gopt_param_type::rms_force [private] |
Definition at line 65 of file gopt_param_types.f90.
Definition at line 60 of file gopt_param_types.f90.
Definition at line 60 of file gopt_param_types.f90.
Definition at line 59 of file gopt_param_types.f90.
REAL(KIND = dp) gopt_param_types::gopt_param_type::wanted_proj_gradient [private] |
Definition at line 64 of file gopt_param_types.f90.
REAL(KIND = dp) gopt_param_types::gopt_param_type::wanted_rel_f_error [private] |
Definition at line 64 of file gopt_param_types.f90.
1.7.3