(git:c5411e0)
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Data Fields | |
character(len=default_string_length) | name = "" |
character(len=default_string_length) | aliases = "" |
real(kind=dp) | kind_radius = 0.0_dp |
real(kind=dp) | short_kind_radius = 0.0_dp |
integer | norm_type = -1 |
integer | ncgf = -1 |
integer | nset = -1 |
integer | nsgf = -1 |
character(len=12), dimension(:), pointer | cgf_symbol => NULL() |
character(len=6), dimension(:), pointer | sgf_symbol => NULL() |
real(kind=dp), dimension(:), pointer | norm_cgf => NULL() |
real(kind=dp), dimension(:), pointer | set_radius => NULL() |
integer, dimension(:), pointer | lmax => NULL() |
integer, dimension(:), pointer | lmin => NULL() |
integer, dimension(:), pointer | lx => NULL() |
integer, dimension(:), pointer | ly => NULL() |
integer, dimension(:), pointer | lz => NULL() |
integer, dimension(:), pointer | m => NULL() |
integer, dimension(:), pointer | ncgf_set => NULL() |
integer, dimension(:), pointer | npgf => NULL() |
integer, dimension(:), pointer | nsgf_set => NULL() |
integer, dimension(:), pointer | nshell => NULL() |
real(kind=dp), dimension(:, :), pointer | cphi => NULL() |
real(kind=dp), dimension(:, :), pointer | pgf_radius => NULL() |
real(kind=dp), dimension(:, :), pointer | sphi => NULL() |
real(kind=dp), dimension(:, :), pointer | scon => NULL() |
real(kind=dp), dimension(:, :), pointer | zet => NULL() |
integer, dimension(:, :), pointer | first_cgf => NULL() |
integer, dimension(:, :), pointer | first_sgf => NULL() |
integer, dimension(:, :), pointer | l => NULL() |
integer, dimension(:, :), pointer | last_cgf => NULL() |
integer, dimension(:, :), pointer | last_sgf => NULL() |
integer, dimension(:, :), pointer | n => NULL() |
real(kind=dp), dimension(:, :, :), pointer | gcc => NULL() |
Definition at line 71 of file basis_set_types.F.
character(len=default_string_length) basis_set_types::gto_basis_set_type::name = "" |
Definition at line 73 of file basis_set_types.F.
character(len=default_string_length) basis_set_types::gto_basis_set_type::aliases = "" |
Definition at line 74 of file basis_set_types.F.
real(kind=dp) basis_set_types::gto_basis_set_type::kind_radius = 0.0_dp |
Definition at line 75 of file basis_set_types.F.
real(kind=dp) basis_set_types::gto_basis_set_type::short_kind_radius = 0.0_dp |
Definition at line 76 of file basis_set_types.F.
integer basis_set_types::gto_basis_set_type::norm_type = -1 |
Definition at line 77 of file basis_set_types.F.
integer basis_set_types::gto_basis_set_type::ncgf = -1 |
Definition at line 78 of file basis_set_types.F.
integer basis_set_types::gto_basis_set_type::nset = -1 |
Definition at line 78 of file basis_set_types.F.
integer basis_set_types::gto_basis_set_type::nsgf = -1 |
Definition at line 78 of file basis_set_types.F.
character(len=12), dimension(:), pointer basis_set_types::gto_basis_set_type::cgf_symbol => NULL() |
Definition at line 79 of file basis_set_types.F.
character(len=6), dimension(:), pointer basis_set_types::gto_basis_set_type::sgf_symbol => NULL() |
Definition at line 80 of file basis_set_types.F.
real(kind=dp), dimension(:), pointer basis_set_types::gto_basis_set_type::norm_cgf => NULL() |
Definition at line 81 of file basis_set_types.F.
real(kind=dp), dimension(:), pointer basis_set_types::gto_basis_set_type::set_radius => NULL() |
Definition at line 81 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::lmax => NULL() |
Definition at line 82 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::lmin => NULL() |
Definition at line 82 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::lx => NULL() |
Definition at line 82 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::ly => NULL() |
Definition at line 82 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::lz => NULL() |
Definition at line 82 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::m => NULL() |
Definition at line 82 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::ncgf_set => NULL() |
Definition at line 82 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::npgf => NULL() |
Definition at line 82 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::nsgf_set => NULL() |
Definition at line 82 of file basis_set_types.F.
integer, dimension(:), pointer basis_set_types::gto_basis_set_type::nshell => NULL() |
Definition at line 82 of file basis_set_types.F.
real(kind=dp), dimension(:, :), pointer basis_set_types::gto_basis_set_type::cphi => NULL() |
Definition at line 86 of file basis_set_types.F.
real(kind=dp), dimension(:, :), pointer basis_set_types::gto_basis_set_type::pgf_radius => NULL() |
Definition at line 86 of file basis_set_types.F.
real(kind=dp), dimension(:, :), pointer basis_set_types::gto_basis_set_type::sphi => NULL() |
Definition at line 86 of file basis_set_types.F.
real(kind=dp), dimension(:, :), pointer basis_set_types::gto_basis_set_type::scon => NULL() |
Definition at line 86 of file basis_set_types.F.
real(kind=dp), dimension(:, :), pointer basis_set_types::gto_basis_set_type::zet => NULL() |
Definition at line 86 of file basis_set_types.F.
integer, dimension(:, :), pointer basis_set_types::gto_basis_set_type::first_cgf => NULL() |
Definition at line 88 of file basis_set_types.F.
integer, dimension(:, :), pointer basis_set_types::gto_basis_set_type::first_sgf => NULL() |
Definition at line 88 of file basis_set_types.F.
integer, dimension(:, :), pointer basis_set_types::gto_basis_set_type::l => NULL() |
Definition at line 88 of file basis_set_types.F.
integer, dimension(:, :), pointer basis_set_types::gto_basis_set_type::last_cgf => NULL() |
Definition at line 88 of file basis_set_types.F.
integer, dimension(:, :), pointer basis_set_types::gto_basis_set_type::last_sgf => NULL() |
Definition at line 88 of file basis_set_types.F.
integer, dimension(:, :), pointer basis_set_types::gto_basis_set_type::n => NULL() |
Definition at line 88 of file basis_set_types.F.
real(kind=dp), dimension(:, :, :), pointer basis_set_types::gto_basis_set_type::gcc => NULL() |
Definition at line 90 of file basis_set_types.F.