Provides info about hartree-fock exchange (For now, we only support potentials that can be represented with Coulomb and longrange-coulomb potential) More...

Data Fields
real(kind=dp)	scale_coulomb = 0.0_dp

real(kind=dp)	scale_longrange = 0.0_dp

real(kind=dp)	omega = 0.0_dp

real(kind=dp), dimension(:, :, :), allocatable	kernel

logical	do_gh = .FALSE.

integer	nr_gh = 0

Detailed Description

Provides info about hartree-fock exchange (For now, we only support potentials that can be represented with Coulomb and longrange-coulomb potential)

Definition at line 184 of file atom_types.F.

Field Documentation

◆ scale_coulomb

real(kind=dp) atom_types::atom_hfx_type::scale_coulomb = 0.0_dp

Definition at line 185 of file atom_types.F.

◆ scale_longrange

real(kind=dp) atom_types::atom_hfx_type::scale_longrange = 0.0_dp

Definition at line 186 of file atom_types.F.

◆ omega

real(kind=dp) atom_types::atom_hfx_type::omega = 0.0_dp

Definition at line 187 of file atom_types.F.

◆ kernel

real(kind=dp), dimension(:, :, :), allocatable atom_types::atom_hfx_type::kernel

Definition at line 188 of file atom_types.F.

◆ do_gh

logical atom_types::atom_hfx_type::do_gh = .FALSE.

Definition at line 189 of file atom_types.F.

◆ nr_gh

integer atom_types::atom_hfx_type::nr_gh = 0

Definition at line 190 of file atom_types.F.

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

atom_types.F

Data Fields