(git:c5411e0)
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Data Fields | |
integer | basis_1c = 0 |
real(kind=dp) | eps_fit = 0.0_dp |
real(kind=dp) | eps_iso = 0.0_dp |
real(kind=dp) | eps_vrho0 = 0.0_dp |
real(kind=dp) | eps_svd = 0.0_dp |
real(kind=dp) | eps_cpc = 0.0_dp |
integer | ladd_rho0 = 0 |
integer | lmax_rho0 = 0 |
integer | lmax_sphere = 0 |
integer | quadrature = 0 |
logical | lrho1_eq_lrho0 = .FALSE. |
logical | alpha0_hard_from_input = .FALSE. |
logical | force_paw = .FALSE. |
logical | non_paw_atoms = .FALSE. |
logical | nopaw_as_gpw = .FALSE. |
real(kind=dp) | alpha0_hard = 0.0_dp |
real(kind=dp) | max_rad_local = 0.0_dp |
Definition at line 198 of file cp_control_types.F.
integer cp_control_types::gapw_control_type::basis_1c = 0 |
Definition at line 199 of file cp_control_types.F.
real(kind=dp) cp_control_types::gapw_control_type::eps_fit = 0.0_dp |
Definition at line 200 of file cp_control_types.F.
real(kind=dp) cp_control_types::gapw_control_type::eps_iso = 0.0_dp |
Definition at line 200 of file cp_control_types.F.
real(kind=dp) cp_control_types::gapw_control_type::eps_vrho0 = 0.0_dp |
Definition at line 200 of file cp_control_types.F.
real(kind=dp) cp_control_types::gapw_control_type::eps_svd = 0.0_dp |
Definition at line 200 of file cp_control_types.F.
real(kind=dp) cp_control_types::gapw_control_type::eps_cpc = 0.0_dp |
Definition at line 200 of file cp_control_types.F.
integer cp_control_types::gapw_control_type::ladd_rho0 = 0 |
Definition at line 205 of file cp_control_types.F.
integer cp_control_types::gapw_control_type::lmax_rho0 = 0 |
Definition at line 205 of file cp_control_types.F.
integer cp_control_types::gapw_control_type::lmax_sphere = 0 |
Definition at line 205 of file cp_control_types.F.
integer cp_control_types::gapw_control_type::quadrature = 0 |
Definition at line 205 of file cp_control_types.F.
logical cp_control_types::gapw_control_type::lrho1_eq_lrho0 = .FALSE. |
Definition at line 209 of file cp_control_types.F.
logical cp_control_types::gapw_control_type::alpha0_hard_from_input = .FALSE. |
Definition at line 210 of file cp_control_types.F.
logical cp_control_types::gapw_control_type::force_paw = .FALSE. |
Definition at line 210 of file cp_control_types.F.
logical cp_control_types::gapw_control_type::non_paw_atoms = .FALSE. |
Definition at line 210 of file cp_control_types.F.
logical cp_control_types::gapw_control_type::nopaw_as_gpw = .FALSE. |
Definition at line 210 of file cp_control_types.F.
real(kind=dp) cp_control_types::gapw_control_type::alpha0_hard = 0.0_dp |
Definition at line 214 of file cp_control_types.F.
real(kind=dp) cp_control_types::gapw_control_type::max_rad_local = 0.0_dp |
Definition at line 215 of file cp_control_types.F.