List of all items

Structs

• SimpleAtomInfo
• basis_io::BasCell
• basis_io::BasCellRaw
• basis_io::BasInfo
• basis_io::Basis4Elem
• basis_io::Basis4ElemRaw
• basis_io::RefCell
• basis_io::bse_downloader::Basis
• basis_io::bse_downloader::Info
• basis_io::bse_downloader::Refs
• basis_io::bse_downloader::Shell
• basis_io::etb::InfoV2
• constants::DMatrix
• constants::SPECIES_INFO
• ctrl_io::InputKeywords
• dft::DFA4REST
• dft::Grids
• dft::gen_grids::bse::Basis
• dft::gen_grids::bse::ElementInfo
• dft::gen_grids::bse::Shell
• dft::libxc::XcFuncType
• dft::libxc::ffi_xc::func_params_type
• dft::libxc::ffi_xc::func_reference_type
• dft::libxc::ffi_xc::max_align_t
• dft::libxc::ffi_xc::xc_dimensions
• dft::libxc::ffi_xc::xc_func_info_type
• dft::libxc::ffi_xc::xc_func_type
• geom_io::GeomCell
• initial_guess::sap::SimpleAtomInfo
• molecule_io::Molecule
• ri_pt2::PT2
• scf_io::SCF
• scf_io::ScfTraceRecord
• utilities::TimeRecords

Enums

• constants::c2s::C2S
• constants::cartesian_gto::CarBasInfo
• ctrl_io::SCFType
• dft::DFAFamily
• dft::libxc::LibXCFamily
• geom_io::EnergyUnit
• geom_io::GeomType
• geom_io::GeomUnit
• geom_io::MOrC
• scf_io::SCFType
• utilities::DebugTiming

Functions

• basis_io::_gaussian_int
• basis_io::basic_math::arccos
• basis_io::basic_math::arcsin
• basis_io::basic_math::arctan
• basis_io::basic_math::double_factorial
• basis_io::basic_math::factorial
• basis_io::basic_math::pi
• basis_io::basic_math::rad2deg
• basis_io::basic_math::specific_double_factorial
• basis_io::basis_list::basis_fuzzy_matcher
• basis_io::basis_list::check_basis_name
• basis_io::bse_downloader::basis_modifier
• basis_io::bse_downloader::bse_auxbas_getter
• basis_io::bse_downloader::bse_basis_getter
• basis_io::bse_downloader::ctrl_element_checker
• basis_io::bse_downloader::elem_indexer
• basis_io::bse_downloader::local_element_checker
• basis_io::cartesian_gto_1st_batch
• basis_io::cartesian_gto_1st_batch_par
• basis_io::cartesian_gto_1st_batch_par_v02
• basis_io::cartesian_gto_1st_batch_v02
• basis_io::cartesian_gto_1st_batch_v03
• basis_io::cartesian_gto_1st_cint
• basis_io::cartesian_gto_1st_cint_batch
• basis_io::cartesian_gto_1st_cint_batch_serial
• basis_io::cartesian_gto_1st_cint_batch_serial_v03
• basis_io::cartesian_gto_1st_std
• basis_io::cartesian_gto_batch
• basis_io::cartesian_gto_batch_par
• basis_io::cartesian_gto_batch_par_v02
• basis_io::cartesian_gto_batch_par_v03
• basis_io::cartesian_gto_batch_v03
• basis_io::cartesian_gto_batch_v04
• basis_io::cartesian_gto_cint
• basis_io::cartesian_gto_cint_batch
• basis_io::cartesian_gto_cint_batch_rayon
• basis_io::cartesian_gto_cint_batch_v04
• basis_io::cartesian_gto_std
• basis_io::cint_norm_factor
• basis_io::etb::etb_gen
• basis_io::etb::etb_gen_for_atom_list
• basis_io::etb::etbs_gen
• basis_io::etb::get_basis_from_mol
• basis_io::etb::get_etb_elem
• basis_io::gto_1st_value
• basis_io::gto_value
• basis_io::gto_value_debug
• basis_io::spheric_gto_1st_value_batch
• basis_io::spheric_gto_1st_value_batch_serial
• basis_io::spheric_gto_1st_value_serial
• basis_io::spheric_gto_value_matrixfull
• basis_io::spheric_gto_value_matrixfull_serial
• basis_io::spheric_gto_value_serial
• constants::c2s::c2s_matrix
• constants::c2s::c2s_matrix_const
• constants::cartesian_gto::cartesian_gto_const
• constants::cartesian_gto::prepare_basinfo
• dft::contract_vxc_0
• dft::gen_grids::atom::atom_grid
• dft::gen_grids::atom::atom_grid_bse
• dft::gen_grids::atom::default_angular_num
• dft::gen_grids::atom::default_radial_num
• dft::gen_grids::atom::get_closest_n_ang
• dft::gen_grids::becke_partitioning::distance
• dft::gen_grids::becke_partitioning::f3
• dft::gen_grids::becke_partitioning::partitioning_weight
• dft::gen_grids::bragg::get_bragg_angstrom
• dft::gen_grids::bse::ang_min_and_max
• dft::gen_grids::comparison::floats_are_same
• dft::gen_grids::lebedev::angular_grid
• dft::gen_grids::lebedev::get_closest_num_angular
• dft::gen_grids::lebedev::valid_input_values
• dft::gen_grids::prune::nwchem_prune
• dft::gen_grids::prune::sg1_prune
• dft::gen_grids::radial::get_h
• dft::gen_grids::radial::get_r_inner
• dft::gen_grids::radial::get_r_outer
• dft::gen_grids::radial::kk_r_w
• dft::gen_grids::radial::radial_grid_gc2nd
• dft::gen_grids::radial::radial_grid_kk
• dft::gen_grids::radial::radial_grid_lmg
• dft::gen_grids::radial::radial_grid_lmg_bse
• dft::gen_grids::radial::radial_grid_treutler
• dft::gen_grids::tables::offsets::offsets
• dft::libxc::ffi_xc::xc_aux_func_ids
• dft::libxc::ffi_xc::xc_aux_func_weights
• dft::libxc::ffi_xc::xc_available_functional_names
• dft::libxc::ffi_xc::xc_available_functional_numbers
• dft::libxc::ffi_xc::xc_available_functional_numbers_by_name
• dft::libxc::ffi_xc::xc_family_from_id
• dft::libxc::ffi_xc::xc_func_alloc
• dft::libxc::ffi_xc::xc_func_end
• dft::libxc::ffi_xc::xc_func_free
• dft::libxc::ffi_xc::xc_func_get_info
• dft::libxc::ffi_xc::xc_func_info_get_ext_params_default_value
• dft::libxc::ffi_xc::xc_func_info_get_ext_params_description
• dft::libxc::ffi_xc::xc_func_info_get_ext_params_name
• dft::libxc::ffi_xc::xc_func_info_get_family
• dft::libxc::ffi_xc::xc_func_info_get_flags
• dft::libxc::ffi_xc::xc_func_info_get_kind
• dft::libxc::ffi_xc::xc_func_info_get_n_ext_params
• dft::libxc::ffi_xc::xc_func_info_get_name
• dft::libxc::ffi_xc::xc_func_info_get_number
• dft::libxc::ffi_xc::xc_func_info_get_references
• dft::libxc::ffi_xc::xc_func_init
• dft::libxc::ffi_xc::xc_func_reference_get_bibtex
• dft::libxc::ffi_xc::xc_func_reference_get_doi
• dft::libxc::ffi_xc::xc_func_reference_get_ref
• dft::libxc::ffi_xc::xc_func_set_dens_threshold
• dft::libxc::ffi_xc::xc_func_set_ext_params
• dft::libxc::ffi_xc::xc_func_set_ext_params_name
• dft::libxc::ffi_xc::xc_func_set_sigma_threshold
• dft::libxc::ffi_xc::xc_func_set_tau_threshold
• dft::libxc::ffi_xc::xc_func_set_zeta_threshold
• dft::libxc::ffi_xc::xc_functional_get_name
• dft::libxc::ffi_xc::xc_functional_get_number
• dft::libxc::ffi_xc::xc_gga
• dft::libxc::ffi_xc::xc_gga_ak13_get_asymptotic
• dft::libxc::ffi_xc::xc_gga_ak13_pars_get_asymptotic
• dft::libxc::ffi_xc::xc_gga_exc
• dft::libxc::ffi_xc::xc_gga_exc_vxc
• dft::libxc::ffi_xc::xc_gga_exc_vxc_fxc
• dft::libxc::ffi_xc::xc_gga_exc_vxc_fxc_kxc
• dft::libxc::ffi_xc::xc_gga_fxc
• dft::libxc::ffi_xc::xc_gga_kxc
• dft::libxc::ffi_xc::xc_gga_lxc
• dft::libxc::ffi_xc::xc_gga_vxc
• dft::libxc::ffi_xc::xc_gga_vxc_fxc
• dft::libxc::ffi_xc::xc_gga_vxc_fxc_kxc
• dft::libxc::ffi_xc::xc_hyb_cam_coef
• dft::libxc::ffi_xc::xc_hyb_exx_coef
• dft::libxc::ffi_xc::xc_lda
• dft::libxc::ffi_xc::xc_lda_exc
• dft::libxc::ffi_xc::xc_lda_exc_vxc
• dft::libxc::ffi_xc::xc_lda_exc_vxc_fxc
• dft::libxc::ffi_xc::xc_lda_exc_vxc_fxc_kxc
• dft::libxc::ffi_xc::xc_lda_fxc
• dft::libxc::ffi_xc::xc_lda_kxc
• dft::libxc::ffi_xc::xc_lda_lxc
• dft::libxc::ffi_xc::xc_lda_vxc
• dft::libxc::ffi_xc::xc_lda_vxc_fxc
• dft::libxc::ffi_xc::xc_lda_vxc_fxc_kxc
• dft::libxc::ffi_xc::xc_maximum_name_length
• dft::libxc::ffi_xc::xc_mgga
• dft::libxc::ffi_xc::xc_mgga_exc
• dft::libxc::ffi_xc::xc_mgga_exc_vxc
• dft::libxc::ffi_xc::xc_mgga_exc_vxc_fxc
• dft::libxc::ffi_xc::xc_mgga_exc_vxc_fxc_kxc
• dft::libxc::ffi_xc::xc_mgga_fxc
• dft::libxc::ffi_xc::xc_mgga_kxc
• dft::libxc::ffi_xc::xc_mgga_lxc
• dft::libxc::ffi_xc::xc_mgga_vxc
• dft::libxc::ffi_xc::xc_mgga_vxc_fxc
• dft::libxc::ffi_xc::xc_mgga_vxc_fxc_kxc
• dft::libxc::ffi_xc::xc_nlc_coef
• dft::libxc::ffi_xc::xc_num_aux_funcs
• dft::libxc::ffi_xc::xc_number_of_functionals
• dft::libxc::ffi_xc::xc_reference
• dft::libxc::ffi_xc::xc_reference_doi
• dft::libxc::ffi_xc::xc_version
• dft::libxc::ffi_xc::xc_version_string
• dft::numerical_density
• dft::par_numerical_density
• dft::prepare_tabulated_sigma
• dft::prepare_tabulated_sigma_rayon
• fciqmc_dump
• geom_io::formated_element_name
• geom_io::get_mass_charge
• get_vsap
• initial_guess::sap::get_vsap
• initial_guess::sap::mid_zeff
• main
• mid_zeff
• molecule_io::count_frozen_core_states
• molecule_io::get_basis_name
• parse_input
• post_scf_analysis::cube_build::gen_box
• post_scf_analysis::cube_build::gen_coords
• post_scf_analysis::cube_build::gen_delta
• post_scf_analysis::cube_build::gen_xs
• post_scf_analysis::cube_build::get_cube
• post_scf_analysis::cube_build::tabulated_ao_fig
• post_scf_analysis::molden_build::gen_header
• post_scf_analysis::molden_build::gen_mo_info
• post_scf_analysis::molden_build::gen_molden
• post_scf_analysis::molden_build::match_angular_momentum
• post_scf_analysis::rand_wf_real_space::gen_c
• post_scf_analysis::rand_wf_real_space::generate_random_points
• post_scf_analysis::rand_wf_real_space::rand_for_mol
• post_scf_analysis::rand_wf_real_space::random_tabulated_ao
• post_scf_analysis::rand_wf_real_space::single_slater
• post_scf_analysis::rand_wf_real_space::slater_determinant
• post_scf_analysis::rand_wf_real_space::tmp_iter_j
• ri_pt2::close_shell_pt2
• ri_pt2::open_shell_pt2
• ri_pt2::xdh_calculations
• ri_rpa::evaluate_response
• ri_rpa::evaluate_rpa_integrand
• ri_rpa::gauss_legendre_grids
• ri_rpa::logarithmic_grid
• ri_rpa::rpa_calculations
• ri_rpa::trans_gauss_legendre_grids
• scf_io::diis_solver
• scf_io::generate_diis_error_vector
• scf_io::scf
• scf_io::vj_full_with_ri_v
• scf_io::vj_upper_with_ri_v
• scf_io::vj_upper_with_ri_v_sync
• scf_io::vk_full_fromdm_with_ri_v
• scf_io::vk_upper_with_ri_v_sync
• utilities::balancing
• utilities::debug_print_slices
• utilities::init_timing
• utilities::omp_get_num_threads
• utilities::omp_set_num_threads
• utilities::openblas_get_num_threads
• utilities::openblas_set_num_threads
• utilities::timing

Type Definitions

• constants::c2s::DMatrix10x7
• constants::c2s::DMatrix15x9
• constants::c2s::DMatrix1x1
• constants::c2s::DMatrix3x3
• constants::c2s::DMatrix6x5
• constants::cartesian_gto::DMatrix4x1
• constants::cartesian_gto::DMatrix4x10
• constants::cartesian_gto::DMatrix4x15
• constants::cartesian_gto::DMatrix4x21
• constants::cartesian_gto::DMatrix4x28
• constants::cartesian_gto::DMatrix4x3
• constants::cartesian_gto::DMatrix4x6
• dft::libxc::ffi_xc::size_t
• dft::libxc::ffi_xc::wchar_t

Statics

• GLOBAL
• dft::gen_grids::parameters::BRAGG0
• dft::gen_grids::parameters::LEBEDEV_NGRID
• dft::gen_grids::parameters::SG1RADII
• dft::gen_grids::tables::coordinates::COORDINATES

Constants

• constants::ANG
• constants::ATOM_CONFIGURATION
• constants::CM
• constants::E
• constants::E5
• constants::E6
• constants::E7
• constants::E8
• constants::E9
• constants::ELEM1ST
• constants::ELEM2ND
• constants::ELEM3RD
• constants::ELEM4TH
• constants::ELEM5TH
• constants::ELEM6TH
• constants::ELEMTMS
• constants::EV
• constants::FQ
• constants::MASS_CHARGE
• constants::PI
• constants::SPECIES_NAME
• constants::c2s::C2S_L0
• constants::c2s::C2S_L1
• constants::c2s::C2S_L2
• constants::c2s::C2S_L3
• constants::c2s::C2S_L4
• constants::cartesian_gto::CAR_BAS_INFO_L0
• constants::cartesian_gto::CAR_BAS_INFO_L1
• constants::cartesian_gto::CAR_BAS_INFO_L2
• constants::cartesian_gto::CAR_BAS_INFO_L3
• constants::cartesian_gto::CAR_BAS_INFO_L4
• constants::cartesian_gto::CAR_BAS_INFO_L5
• constants::cartesian_gto::CAR_BAS_INFO_L6
• constants::vsap::ARR
• dft::gen_grids::parameters::BOHR
• dft::gen_grids::parameters::SMALL
• dft::gen_grids::tables::coordinates::F
• dft::gen_grids::tables::weights::WEIGHTS
• dft::libxc::ffi_xc::XC_CORRELATION
• dft::libxc::ffi_xc::XC_EXCHANGE
• dft::libxc::ffi_xc::XC_EXCHANGE_CORRELATION
• dft::libxc::ffi_xc::XC_EXT_PARAMS_DEFAULT
• dft::libxc::ffi_xc::XC_FAMILY_GGA
• dft::libxc::ffi_xc::XC_FAMILY_HYB_GGA
• dft::libxc::ffi_xc::XC_FAMILY_HYB_LDA
• dft::libxc::ffi_xc::XC_FAMILY_HYB_MGGA
• dft::libxc::ffi_xc::XC_FAMILY_LCA
• dft::libxc::ffi_xc::XC_FAMILY_LDA
• dft::libxc::ffi_xc::XC_FAMILY_MGGA
• dft::libxc::ffi_xc::XC_FAMILY_OEP
• dft::libxc::ffi_xc::XC_FAMILY_UNKNOWN
• dft::libxc::ffi_xc::XC_FLAGS_1D
• dft::libxc::ffi_xc::XC_FLAGS_2D
• dft::libxc::ffi_xc::XC_FLAGS_3D
• dft::libxc::ffi_xc::XC_FLAGS_DEVELOPMENT
• dft::libxc::ffi_xc::XC_FLAGS_HAVE_ALL
• dft::libxc::ffi_xc::XC_FLAGS_HAVE_EXC
• dft::libxc::ffi_xc::XC_FLAGS_HAVE_FXC
• dft::libxc::ffi_xc::XC_FLAGS_HAVE_KXC
• dft::libxc::ffi_xc::XC_FLAGS_HAVE_LXC
• dft::libxc::ffi_xc::XC_FLAGS_HAVE_VXC
• dft::libxc::ffi_xc::XC_FLAGS_HYB_CAM
• dft::libxc::ffi_xc::XC_FLAGS_HYB_CAMY
• dft::libxc::ffi_xc::XC_FLAGS_HYB_LC
• dft::libxc::ffi_xc::XC_FLAGS_HYB_LCY
• dft::libxc::ffi_xc::XC_FLAGS_NEEDS_LAPLACIAN
• dft::libxc::ffi_xc::XC_FLAGS_STABLE
• dft::libxc::ffi_xc::XC_FLAGS_VV10
• dft::libxc::ffi_xc::XC_GGA_C_ACGGA
• dft::libxc::ffi_xc::XC_GGA_C_ACGGAP
• dft::libxc::ffi_xc::XC_GGA_C_AM05
• dft::libxc::ffi_xc::XC_GGA_C_APBE
• dft::libxc::ffi_xc::XC_GGA_C_BCGP
• dft::libxc::ffi_xc::XC_GGA_C_BGCP
• dft::libxc::ffi_xc::XC_GGA_C_BMK
• dft::libxc::ffi_xc::XC_GGA_C_CCDF
• dft::libxc::ffi_xc::XC_GGA_C_CHACHIYO
• dft::libxc::ffi_xc::XC_GGA_C_CS1
• dft::libxc::ffi_xc::XC_GGA_C_FT97
• dft::libxc::ffi_xc::XC_GGA_C_GAM
• dft::libxc::ffi_xc::XC_GGA_C_GAPC
• dft::libxc::ffi_xc::XC_GGA_C_GAPLOC
• dft::libxc::ffi_xc::XC_GGA_C_HCTH_A
• dft::libxc::ffi_xc::XC_GGA_C_HYB_TAU_HCTH
• dft::libxc::ffi_xc::XC_GGA_C_LM
• dft::libxc::ffi_xc::XC_GGA_C_LYP
• dft::libxc::ffi_xc::XC_GGA_C_LYPR
• dft::libxc::ffi_xc::XC_GGA_C_MGGAC
• dft::libxc::ffi_xc::XC_GGA_C_N12
• dft::libxc::ffi_xc::XC_GGA_C_N12_SX
• dft::libxc::ffi_xc::XC_GGA_C_OPTC
• dft::libxc::ffi_xc::XC_GGA_C_OP_B88
• dft::libxc::ffi_xc::XC_GGA_C_OP_G96
• dft::libxc::ffi_xc::XC_GGA_C_OP_PBE
• dft::libxc::ffi_xc::XC_GGA_C_OP_PW91
• dft::libxc::ffi_xc::XC_GGA_C_OP_XALPHA
• dft::libxc::ffi_xc::XC_GGA_C_P86
• dft::libxc::ffi_xc::XC_GGA_C_P86VWN
• dft::libxc::ffi_xc::XC_GGA_C_P86VWN_FT
• dft::libxc::ffi_xc::XC_GGA_C_P86_FT
• dft::libxc::ffi_xc::XC_GGA_C_PBE
• dft::libxc::ffi_xc::XC_GGA_C_PBEFE
• dft::libxc::ffi_xc::XC_GGA_C_PBEINT
• dft::libxc::ffi_xc::XC_GGA_C_PBELOC
• dft::libxc::ffi_xc::XC_GGA_C_PBE_JRGX
• dft::libxc::ffi_xc::XC_GGA_C_PBE_MOL
• dft::libxc::ffi_xc::XC_GGA_C_PBE_SOL
• dft::libxc::ffi_xc::XC_GGA_C_PBE_VWN
• dft::libxc::ffi_xc::XC_GGA_C_PW91
• dft::libxc::ffi_xc::XC_GGA_C_Q2D
• dft::libxc::ffi_xc::XC_GGA_C_REGTPSS
• dft::libxc::ffi_xc::XC_GGA_C_REVTCA
• dft::libxc::ffi_xc::XC_GGA_C_RGE2
• dft::libxc::ffi_xc::XC_GGA_C_SCAN_E0
• dft::libxc::ffi_xc::XC_GGA_C_SG4
• dft::libxc::ffi_xc::XC_GGA_C_SOGGA11
• dft::libxc::ffi_xc::XC_GGA_C_SOGGA11_X
• dft::libxc::ffi_xc::XC_GGA_C_SPBE
• dft::libxc::ffi_xc::XC_GGA_C_TAU_HCTH
• dft::libxc::ffi_xc::XC_GGA_C_TCA
• dft::libxc::ffi_xc::XC_GGA_C_TM_LYP
• dft::libxc::ffi_xc::XC_GGA_C_TM_PBE
• dft::libxc::ffi_xc::XC_GGA_C_VPBE
• dft::libxc::ffi_xc::XC_GGA_C_W94
• dft::libxc::ffi_xc::XC_GGA_C_WI
• dft::libxc::ffi_xc::XC_GGA_C_WI0
• dft::libxc::ffi_xc::XC_GGA_C_WL
• dft::libxc::ffi_xc::XC_GGA_C_XPBE
• dft::libxc::ffi_xc::XC_GGA_C_ZPBEINT
• dft::libxc::ffi_xc::XC_GGA_C_ZPBESOL
• dft::libxc::ffi_xc::XC_GGA_C_ZVPBEINT
• dft::libxc::ffi_xc::XC_GGA_C_ZVPBELOC
• dft::libxc::ffi_xc::XC_GGA_C_ZVPBESOL
• dft::libxc::ffi_xc::XC_GGA_K_ABSP1
• dft::libxc::ffi_xc::XC_GGA_K_ABSP2
• dft::libxc::ffi_xc::XC_GGA_K_ABSP3
• dft::libxc::ffi_xc::XC_GGA_K_ABSP4
• dft::libxc::ffi_xc::XC_GGA_K_ABSR1
• dft::libxc::ffi_xc::XC_GGA_K_ABSR2
• dft::libxc::ffi_xc::XC_GGA_K_APBE
• dft::libxc::ffi_xc::XC_GGA_K_APBEINT
• dft::libxc::ffi_xc::XC_GGA_K_BALTIN
• dft::libxc::ffi_xc::XC_GGA_K_DK
• dft::libxc::ffi_xc::XC_GGA_K_ERNZERHOF
• dft::libxc::ffi_xc::XC_GGA_K_EXP4
• dft::libxc::ffi_xc::XC_GGA_K_FR_B88
• dft::libxc::ffi_xc::XC_GGA_K_FR_PW86
• dft::libxc::ffi_xc::XC_GGA_K_GDS08
• dft::libxc::ffi_xc::XC_GGA_K_GE2
• dft::libxc::ffi_xc::XC_GGA_K_GHDS10
• dft::libxc::ffi_xc::XC_GGA_K_GHDS10R
• dft::libxc::ffi_xc::XC_GGA_K_GOLDEN
• dft::libxc::ffi_xc::XC_GGA_K_GP85
• dft::libxc::ffi_xc::XC_GGA_K_GR
• dft::libxc::ffi_xc::XC_GGA_K_LC94
• dft::libxc::ffi_xc::XC_GGA_K_LGAP
• dft::libxc::ffi_xc::XC_GGA_K_LGAP_GE
• dft::libxc::ffi_xc::XC_GGA_K_LIEB
• dft::libxc::ffi_xc::XC_GGA_K_LKT
• dft::libxc::ffi_xc::XC_GGA_K_LLP
• dft::libxc::ffi_xc::XC_GGA_K_LUDENA
• dft::libxc::ffi_xc::XC_GGA_K_MEYER
• dft::libxc::ffi_xc::XC_GGA_K_OL1
• dft::libxc::ffi_xc::XC_GGA_K_OL2
• dft::libxc::ffi_xc::XC_GGA_K_PBE2
• dft::libxc::ffi_xc::XC_GGA_K_PBE3
• dft::libxc::ffi_xc::XC_GGA_K_PBE4
• dft::libxc::ffi_xc::XC_GGA_K_PEARSON
• dft::libxc::ffi_xc::XC_GGA_K_PERDEW
• dft::libxc::ffi_xc::XC_GGA_K_PG1
• dft::libxc::ffi_xc::XC_GGA_K_RATIONAL_P
• dft::libxc::ffi_xc::XC_GGA_K_REVAPBE
• dft::libxc::ffi_xc::XC_GGA_K_REVAPBEINT
• dft::libxc::ffi_xc::XC_GGA_K_TFVW
• dft::libxc::ffi_xc::XC_GGA_K_TFVW_OPT
• dft::libxc::ffi_xc::XC_GGA_K_THAKKAR
• dft::libxc::ffi_xc::XC_GGA_K_TKVLN
• dft::libxc::ffi_xc::XC_GGA_K_TW1
• dft::libxc::ffi_xc::XC_GGA_K_TW2
• dft::libxc::ffi_xc::XC_GGA_K_TW3
• dft::libxc::ffi_xc::XC_GGA_K_TW4
• dft::libxc::ffi_xc::XC_GGA_K_VJKS
• dft::libxc::ffi_xc::XC_GGA_K_VSK
• dft::libxc::ffi_xc::XC_GGA_K_VT84F
• dft::libxc::ffi_xc::XC_GGA_K_VW
• dft::libxc::ffi_xc::XC_GGA_K_YT65
• dft::libxc::ffi_xc::XC_GGA_XC_B97
• dft::libxc::ffi_xc::XC_GGA_XC_B97_1
• dft::libxc::ffi_xc::XC_GGA_XC_B97_2
• dft::libxc::ffi_xc::XC_GGA_XC_B97_3
• dft::libxc::ffi_xc::XC_GGA_XC_B97_D
• dft::libxc::ffi_xc::XC_GGA_XC_B97_GGA1
• dft::libxc::ffi_xc::XC_GGA_XC_B97_K
• dft::libxc::ffi_xc::XC_GGA_XC_BEEFVDW
• dft::libxc::ffi_xc::XC_GGA_XC_EDF1
• dft::libxc::ffi_xc::XC_GGA_XC_HCTH_120
• dft::libxc::ffi_xc::XC_GGA_XC_HCTH_147
• dft::libxc::ffi_xc::XC_GGA_XC_HCTH_407
• dft::libxc::ffi_xc::XC_GGA_XC_HCTH_407P
• dft::libxc::ffi_xc::XC_GGA_XC_HCTH_93
• dft::libxc::ffi_xc::XC_GGA_XC_HCTH_P14
• dft::libxc::ffi_xc::XC_GGA_XC_HCTH_P76
• dft::libxc::ffi_xc::XC_GGA_XC_HLE16
• dft::libxc::ffi_xc::XC_GGA_XC_KT1
• dft::libxc::ffi_xc::XC_GGA_XC_KT2
• dft::libxc::ffi_xc::XC_GGA_XC_KT3
• dft::libxc::ffi_xc::XC_GGA_XC_LB
• dft::libxc::ffi_xc::XC_GGA_XC_MOHLYP
• dft::libxc::ffi_xc::XC_GGA_XC_MOHLYP2
• dft::libxc::ffi_xc::XC_GGA_XC_MPWLYP1W
• dft::libxc::ffi_xc::XC_GGA_XC_NCAP
• dft::libxc::ffi_xc::XC_GGA_XC_OBLYP_D
• dft::libxc::ffi_xc::XC_GGA_XC_OPBE_D
• dft::libxc::ffi_xc::XC_GGA_XC_OPWLYP_D
• dft::libxc::ffi_xc::XC_GGA_XC_PBE1W
• dft::libxc::ffi_xc::XC_GGA_XC_PBELYP1W
• dft::libxc::ffi_xc::XC_GGA_XC_SB98_1a
• dft::libxc::ffi_xc::XC_GGA_XC_SB98_1b
• dft::libxc::ffi_xc::XC_GGA_XC_SB98_1c
• dft::libxc::ffi_xc::XC_GGA_XC_SB98_2a
• dft::libxc::ffi_xc::XC_GGA_XC_SB98_2b
• dft::libxc::ffi_xc::XC_GGA_XC_SB98_2c
• dft::libxc::ffi_xc::XC_GGA_XC_TH1
• dft::libxc::ffi_xc::XC_GGA_XC_TH2
• dft::libxc::ffi_xc::XC_GGA_XC_TH3
• dft::libxc::ffi_xc::XC_GGA_XC_TH4
• dft::libxc::ffi_xc::XC_GGA_XC_TH_FC
• dft::libxc::ffi_xc::XC_GGA_XC_TH_FCFO
• dft::libxc::ffi_xc::XC_GGA_XC_TH_FCO
• dft::libxc::ffi_xc::XC_GGA_XC_TH_FL
• dft::libxc::ffi_xc::XC_GGA_XC_VV10
• dft::libxc::ffi_xc::XC_GGA_XC_WB97
• dft::libxc::ffi_xc::XC_GGA_XC_WB97X
• dft::libxc::ffi_xc::XC_GGA_XC_WB97X_D
• dft::libxc::ffi_xc::XC_GGA_XC_WB97X_V
• dft::libxc::ffi_xc::XC_GGA_XC_XLYP
• dft::libxc::ffi_xc::XC_GGA_X_2D_B86
• dft::libxc::ffi_xc::XC_GGA_X_2D_B86_MGC
• dft::libxc::ffi_xc::XC_GGA_X_2D_B88
• dft::libxc::ffi_xc::XC_GGA_X_2D_PBE
• dft::libxc::ffi_xc::XC_GGA_X_AIRY
• dft::libxc::ffi_xc::XC_GGA_X_AK13
• dft::libxc::ffi_xc::XC_GGA_X_AM05
• dft::libxc::ffi_xc::XC_GGA_X_APBE
• dft::libxc::ffi_xc::XC_GGA_X_B86
• dft::libxc::ffi_xc::XC_GGA_X_B86_MGC
• dft::libxc::ffi_xc::XC_GGA_X_B86_R
• dft::libxc::ffi_xc::XC_GGA_X_B88
• dft::libxc::ffi_xc::XC_GGA_X_B88M
• dft::libxc::ffi_xc::XC_GGA_X_B88_6311G
• dft::libxc::ffi_xc::XC_GGA_X_BAYESIAN
• dft::libxc::ffi_xc::XC_GGA_X_BCGP
• dft::libxc::ffi_xc::XC_GGA_X_BEEFVDW
• dft::libxc::ffi_xc::XC_GGA_X_BGCP
• dft::libxc::ffi_xc::XC_GGA_X_BPCCAC
• dft::libxc::ffi_xc::XC_GGA_X_C09X
• dft::libxc::ffi_xc::XC_GGA_X_CAP
• dft::libxc::ffi_xc::XC_GGA_X_CHACHIYO
• dft::libxc::ffi_xc::XC_GGA_X_DK87_R1
• dft::libxc::ffi_xc::XC_GGA_X_DK87_R2
• dft::libxc::ffi_xc::XC_GGA_X_EB88
• dft::libxc::ffi_xc::XC_GGA_X_ECMV92
• dft::libxc::ffi_xc::XC_GGA_X_EV93
• dft::libxc::ffi_xc::XC_GGA_X_FD_LB94
• dft::libxc::ffi_xc::XC_GGA_X_FD_REVLB94
• dft::libxc::ffi_xc::XC_GGA_X_FT97_A
• dft::libxc::ffi_xc::XC_GGA_X_FT97_B
• dft::libxc::ffi_xc::XC_GGA_X_G96
• dft::libxc::ffi_xc::XC_GGA_X_GAM
• dft::libxc::ffi_xc::XC_GGA_X_GG99
• dft::libxc::ffi_xc::XC_GGA_X_HCTH_A
• dft::libxc::ffi_xc::XC_GGA_X_HERMAN
• dft::libxc::ffi_xc::XC_GGA_X_HJS_B88
• dft::libxc::ffi_xc::XC_GGA_X_HJS_B88_V2
• dft::libxc::ffi_xc::XC_GGA_X_HJS_B97X
• dft::libxc::ffi_xc::XC_GGA_X_HJS_PBE
• dft::libxc::ffi_xc::XC_GGA_X_HJS_PBE_SOL
• dft::libxc::ffi_xc::XC_GGA_X_HTBS
• dft::libxc::ffi_xc::XC_GGA_X_ITYH
• dft::libxc::ffi_xc::XC_GGA_X_ITYH_OPTX
• dft::libxc::ffi_xc::XC_GGA_X_ITYH_PBE
• dft::libxc::ffi_xc::XC_GGA_X_KGG99
• dft::libxc::ffi_xc::XC_GGA_X_KT1
• dft::libxc::ffi_xc::XC_GGA_X_LAG
• dft::libxc::ffi_xc::XC_GGA_X_LAMBDA_CH_N
• dft::libxc::ffi_xc::XC_GGA_X_LAMBDA_LO_N
• dft::libxc::ffi_xc::XC_GGA_X_LAMBDA_OC2_N
• dft::libxc::ffi_xc::XC_GGA_X_LB
• dft::libxc::ffi_xc::XC_GGA_X_LBM
• dft::libxc::ffi_xc::XC_GGA_X_LG93
• dft::libxc::ffi_xc::XC_GGA_X_LSPBE
• dft::libxc::ffi_xc::XC_GGA_X_LSRPBE
• dft::libxc::ffi_xc::XC_GGA_X_LV_RPW86
• dft::libxc::ffi_xc::XC_GGA_X_MB88
• dft::libxc::ffi_xc::XC_GGA_X_MPBE
• dft::libxc::ffi_xc::XC_GGA_X_MPW91
• dft::libxc::ffi_xc::XC_GGA_X_N12
• dft::libxc::ffi_xc::XC_GGA_X_NCAP
• dft::libxc::ffi_xc::XC_GGA_X_OL2
• dft::libxc::ffi_xc::XC_GGA_X_OPTB86B_VDW
• dft::libxc::ffi_xc::XC_GGA_X_OPTB88_VDW
• dft::libxc::ffi_xc::XC_GGA_X_OPTPBE_VDW
• dft::libxc::ffi_xc::XC_GGA_X_OPTX
• dft::libxc::ffi_xc::XC_GGA_X_PBE
• dft::libxc::ffi_xc::XC_GGA_X_PBEA
• dft::libxc::ffi_xc::XC_GGA_X_PBEFE
• dft::libxc::ffi_xc::XC_GGA_X_PBEINT
• dft::libxc::ffi_xc::XC_GGA_X_PBEK1_VDW
• dft::libxc::ffi_xc::XC_GGA_X_PBEPOW
• dft::libxc::ffi_xc::XC_GGA_X_PBETRANS
• dft::libxc::ffi_xc::XC_GGA_X_PBE_JSJR
• dft::libxc::ffi_xc::XC_GGA_X_PBE_MOL
• dft::libxc::ffi_xc::XC_GGA_X_PBE_R
• dft::libxc::ffi_xc::XC_GGA_X_PBE_SOL
• dft::libxc::ffi_xc::XC_GGA_X_PBE_TCA
• dft::libxc::ffi_xc::XC_GGA_X_PBEpow
• dft::libxc::ffi_xc::XC_GGA_X_PW86
• dft::libxc::ffi_xc::XC_GGA_X_PW91
• dft::libxc::ffi_xc::XC_GGA_X_PW91_MOD
• dft::libxc::ffi_xc::XC_GGA_X_Q1D
• dft::libxc::ffi_xc::XC_GGA_X_Q2D
• dft::libxc::ffi_xc::XC_GGA_X_REVSSB_D
• dft::libxc::ffi_xc::XC_GGA_X_RGE2
• dft::libxc::ffi_xc::XC_GGA_X_RPBE
• dft::libxc::ffi_xc::XC_GGA_X_RPW86
• dft::libxc::ffi_xc::XC_GGA_X_S12G
• dft::libxc::ffi_xc::XC_GGA_X_SFAT
• dft::libxc::ffi_xc::XC_GGA_X_SFAT_PBE
• dft::libxc::ffi_xc::XC_GGA_X_SG4
• dft::libxc::ffi_xc::XC_GGA_X_SOGGA
• dft::libxc::ffi_xc::XC_GGA_X_SOGGA11
• dft::libxc::ffi_xc::XC_GGA_X_SSB
• dft::libxc::ffi_xc::XC_GGA_X_SSB_D
• dft::libxc::ffi_xc::XC_GGA_X_SSB_SW
• dft::libxc::ffi_xc::XC_GGA_X_VMT84_GE
• dft::libxc::ffi_xc::XC_GGA_X_VMT84_PBE
• dft::libxc::ffi_xc::XC_GGA_X_VMT_GE
• dft::libxc::ffi_xc::XC_GGA_X_VMT_PBE
• dft::libxc::ffi_xc::XC_GGA_X_WC
• dft::libxc::ffi_xc::XC_GGA_X_WPBEH
• dft::libxc::ffi_xc::XC_GGA_X_XPBE
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_APBE0
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_APF
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B1LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B1PW91
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B1WC
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B3LYP3
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B3LYP5
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B3LYPS
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B3LYP_MCM1
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B3LYP_MCM2
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B3LYPs
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B3P86
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B3PW91
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B5050LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B97
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B97_1
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B97_1P
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B97_1p
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B97_2
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B97_3
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_B97_K
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_BHANDH
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_BHANDHLYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_BLYP35
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAMH_B3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAMY_B3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAMY_BLYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAMY_PBEH
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAM_B3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAM_O3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAM_PBEH
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAM_QTP_00
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAM_QTP_01
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAM_QTP_02
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CAP0
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_CASE21
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_EDF2
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HAPBE
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HFLYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HJS_B88
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HJS_B97X
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HJS_PBE
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HJS_PBE_SOL
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HPBEINT
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HSE03
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HSE06
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HSE12
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HSE12S
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_HSE_SOL
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_KMLYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LB07
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LCY_BLYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LCY_PBE
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_BLYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_BLYPR
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_BLYP_EA
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_BOP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_PBEOP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_QTP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_VV10
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_WPBE
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_WPBE08_WHS
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_WPBEH_WHS
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_WPBESOL_WHS
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LC_WPBE_WHS
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LRC_WPBE
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_LRC_WPBEH
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_MB3LYP_RC04
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_MCAM_B3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_MPW1K
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_MPW1LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_MPW1PBE
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_MPW1PW
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_MPW3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_MPW3PW
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_MPWLYP1M
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_O3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_PBE0_13
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_PBE38
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_PBE50
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_PBEB0
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_PBEH
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_PBE_2X
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_PBE_MOL0
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_PBE_MOLB0
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_PBE_SOL0
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_QTP17
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_RCAM_B3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_REVB3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_1A
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_1B
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_1C
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_1a
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_1b
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_1c
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_2A
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_2B
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_2C
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_2a
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_2b
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_SB98_2c
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_TUNED_CAM_B3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_WB97
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_WB97X
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_WB97X_D
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_WB97X_D3
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_WB97X_V
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_WC04
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_WHPBE0
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_WP04
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_X3LYP
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_mPW1K
• dft::libxc::ffi_xc::XC_HYB_GGA_XC_mPW1PW
• dft::libxc::ffi_xc::XC_HYB_GGA_X_CAM_S12G
• dft::libxc::ffi_xc::XC_HYB_GGA_X_CAM_S12H
• dft::libxc::ffi_xc::XC_HYB_GGA_X_N12_SX
• dft::libxc::ffi_xc::XC_HYB_GGA_X_S12H
• dft::libxc::ffi_xc::XC_HYB_GGA_X_SOGGA11_X
• dft::libxc::ffi_xc::XC_HYB_LDA_XC_BN05
• dft::libxc::ffi_xc::XC_HYB_LDA_XC_CAM_LDA0
• dft::libxc::ffi_xc::XC_HYB_LDA_XC_LDA0
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_B0KCIS
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_B86B95
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_B88B95
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_B94_HYB
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_B98
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_BB1K
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_EDMGGAH
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_LC_TMLYP
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_M08_HX
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_M08_SO
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_M11
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_MPW1B95
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_MPW1KCIS
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_MPWB1K
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_MPWKCIS1K
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_PBE1KCIS
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_PW6B95
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_PW86B95
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_PWB6K
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_REVTPSSH
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_TPSS0
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_TPSS1KCIS
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_TPSSH
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_WB97M_V
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_X1B95
• dft::libxc::ffi_xc::XC_HYB_MGGA_XC_XB1K
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_BMK
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_DLDF
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_JS18
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_M05
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_M05_2X
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_M06
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_M06_2X
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_M06_HF
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_M06_SX
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_M08_HX
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_M08_SO
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_M11
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_MN12_SX
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_MN15
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_MS2H
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_MVSH
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_PJS18
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_REVM06
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_REVM11
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_REVSCAN0
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_SCAN0
• dft::libxc::ffi_xc::XC_HYB_MGGA_X_TAU_HCTH
• dft::libxc::ffi_xc::XC_KINETIC
• dft::libxc::ffi_xc::XC_LDA_C_1D_CSC
• dft::libxc::ffi_xc::XC_LDA_C_1D_LOOS
• dft::libxc::ffi_xc::XC_LDA_C_2D_AMGB
• dft::libxc::ffi_xc::XC_LDA_C_2D_PRM
• dft::libxc::ffi_xc::XC_LDA_C_BR78
• dft::libxc::ffi_xc::XC_LDA_C_CHACHIYO
• dft::libxc::ffi_xc::XC_LDA_C_CHACHIYO_MOD
• dft::libxc::ffi_xc::XC_LDA_C_GK72
• dft::libxc::ffi_xc::XC_LDA_C_GL
• dft::libxc::ffi_xc::XC_LDA_C_GOMBAS
• dft::libxc::ffi_xc::XC_LDA_C_HL
• dft::libxc::ffi_xc::XC_LDA_C_KARASIEV
• dft::libxc::ffi_xc::XC_LDA_C_KARASIEV_MOD
• dft::libxc::ffi_xc::XC_LDA_C_LP96
• dft::libxc::ffi_xc::XC_LDA_C_LP_A
• dft::libxc::ffi_xc::XC_LDA_C_LP_B
• dft::libxc::ffi_xc::XC_LDA_C_MCWEENY
• dft::libxc::ffi_xc::XC_LDA_C_ML1
• dft::libxc::ffi_xc::XC_LDA_C_ML2
• dft::libxc::ffi_xc::XC_LDA_C_OB_PW
• dft::libxc::ffi_xc::XC_LDA_C_OB_PZ
• dft::libxc::ffi_xc::XC_LDA_C_OW
• dft::libxc::ffi_xc::XC_LDA_C_OW_LYP
• dft::libxc::ffi_xc::XC_LDA_C_PK09
• dft::libxc::ffi_xc::XC_LDA_C_PMGB06
• dft::libxc::ffi_xc::XC_LDA_C_PW
• dft::libxc::ffi_xc::XC_LDA_C_PW_MOD
• dft::libxc::ffi_xc::XC_LDA_C_PW_RPA
• dft::libxc::ffi_xc::XC_LDA_C_PZ
• dft::libxc::ffi_xc::XC_LDA_C_PZ_MOD
• dft::libxc::ffi_xc::XC_LDA_C_RC04
• dft::libxc::ffi_xc::XC_LDA_C_RPA
• dft::libxc::ffi_xc::XC_LDA_C_RPW92
• dft::libxc::ffi_xc::XC_LDA_C_UPW92
• dft::libxc::ffi_xc::XC_LDA_C_VBH
• dft::libxc::ffi_xc::XC_LDA_C_VWN
• dft::libxc::ffi_xc::XC_LDA_C_VWN_1
• dft::libxc::ffi_xc::XC_LDA_C_VWN_2
• dft::libxc::ffi_xc::XC_LDA_C_VWN_3
• dft::libxc::ffi_xc::XC_LDA_C_VWN_4
• dft::libxc::ffi_xc::XC_LDA_C_VWN_RPA
• dft::libxc::ffi_xc::XC_LDA_C_W20
• dft::libxc::ffi_xc::XC_LDA_C_WIGNER
• dft::libxc::ffi_xc::XC_LDA_C_XALPHA
• dft::libxc::ffi_xc::XC_LDA_C_vBH
• dft::libxc::ffi_xc::XC_LDA_K_LP
• dft::libxc::ffi_xc::XC_LDA_K_LP96
• dft::libxc::ffi_xc::XC_LDA_K_TF
• dft::libxc::ffi_xc::XC_LDA_K_ZLP
• dft::libxc::ffi_xc::XC_LDA_X
• dft::libxc::ffi_xc::XC_LDA_XC_1D_EHWLRG_1
• dft::libxc::ffi_xc::XC_LDA_XC_1D_EHWLRG_2
• dft::libxc::ffi_xc::XC_LDA_XC_1D_EHWLRG_3
• dft::libxc::ffi_xc::XC_LDA_XC_CORRKSDT
• dft::libxc::ffi_xc::XC_LDA_XC_GDSMFB
• dft::libxc::ffi_xc::XC_LDA_XC_KSDT
• dft::libxc::ffi_xc::XC_LDA_XC_LP_A
• dft::libxc::ffi_xc::XC_LDA_XC_LP_B
• dft::libxc::ffi_xc::XC_LDA_XC_TETER93
• dft::libxc::ffi_xc::XC_LDA_XC_TIH
• dft::libxc::ffi_xc::XC_LDA_XC_ZLP
• dft::libxc::ffi_xc::XC_LDA_X_1D
• dft::libxc::ffi_xc::XC_LDA_X_1D_EXPONENTIAL
• dft::libxc::ffi_xc::XC_LDA_X_1D_SOFT
• dft::libxc::ffi_xc::XC_LDA_X_2D
• dft::libxc::ffi_xc::XC_LDA_X_ERF
• dft::libxc::ffi_xc::XC_LDA_X_RAE
• dft::libxc::ffi_xc::XC_LDA_X_REL
• dft::libxc::ffi_xc::XC_LDA_X_SLOC
• dft::libxc::ffi_xc::XC_LDA_X_YUKAWA
• dft::libxc::ffi_xc::XC_MAX_REFERENCES
• dft::libxc::ffi_xc::XC_MGGA_C_B88
• dft::libxc::ffi_xc::XC_MGGA_C_B94
• dft::libxc::ffi_xc::XC_MGGA_C_BC95
• dft::libxc::ffi_xc::XC_MGGA_C_CC06
• dft::libxc::ffi_xc::XC_MGGA_C_CS
• dft::libxc::ffi_xc::XC_MGGA_C_DLDF
• dft::libxc::ffi_xc::XC_MGGA_C_HLTAPW
• dft::libxc::ffi_xc::XC_MGGA_C_KCIS
• dft::libxc::ffi_xc::XC_MGGA_C_KCISK
• dft::libxc::ffi_xc::XC_MGGA_C_LP90
• dft::libxc::ffi_xc::XC_MGGA_C_M05
• dft::libxc::ffi_xc::XC_MGGA_C_M05_2X
• dft::libxc::ffi_xc::XC_MGGA_C_M06
• dft::libxc::ffi_xc::XC_MGGA_C_M06_2X
• dft::libxc::ffi_xc::XC_MGGA_C_M06_HF
• dft::libxc::ffi_xc::XC_MGGA_C_M06_L
• dft::libxc::ffi_xc::XC_MGGA_C_M06_SX
• dft::libxc::ffi_xc::XC_MGGA_C_M08_HX
• dft::libxc::ffi_xc::XC_MGGA_C_M08_SO
• dft::libxc::ffi_xc::XC_MGGA_C_M11
• dft::libxc::ffi_xc::XC_MGGA_C_M11_L
• dft::libxc::ffi_xc::XC_MGGA_C_MN12_L
• dft::libxc::ffi_xc::XC_MGGA_C_MN12_SX
• dft::libxc::ffi_xc::XC_MGGA_C_MN15
• dft::libxc::ffi_xc::XC_MGGA_C_MN15_L
• dft::libxc::ffi_xc::XC_MGGA_C_PKZB
• dft::libxc::ffi_xc::XC_MGGA_C_R2SCAN
• dft::libxc::ffi_xc::XC_MGGA_C_R2SCAN01
• dft::libxc::ffi_xc::XC_MGGA_C_R2SCANL
• dft::libxc::ffi_xc::XC_MGGA_C_REVM06
• dft::libxc::ffi_xc::XC_MGGA_C_REVM06_L
• dft::libxc::ffi_xc::XC_MGGA_C_REVM11
• dft::libxc::ffi_xc::XC_MGGA_C_REVSCAN
• dft::libxc::ffi_xc::XC_MGGA_C_REVSCAN_VV10
• dft::libxc::ffi_xc::XC_MGGA_C_REVTM
• dft::libxc::ffi_xc::XC_MGGA_C_REVTPSS
• dft::libxc::ffi_xc::XC_MGGA_C_RMGGAC
• dft::libxc::ffi_xc::XC_MGGA_C_RPPSCAN
• dft::libxc::ffi_xc::XC_MGGA_C_RREGTM
• dft::libxc::ffi_xc::XC_MGGA_C_RSCAN
• dft::libxc::ffi_xc::XC_MGGA_C_SCAN
• dft::libxc::ffi_xc::XC_MGGA_C_SCANL
• dft::libxc::ffi_xc::XC_MGGA_C_SCANL_RVV10
• dft::libxc::ffi_xc::XC_MGGA_C_SCANL_VV10
• dft::libxc::ffi_xc::XC_MGGA_C_SCAN_RVV10
• dft::libxc::ffi_xc::XC_MGGA_C_SCAN_VV10
• dft::libxc::ffi_xc::XC_MGGA_C_TM
• dft::libxc::ffi_xc::XC_MGGA_C_TPSS
• dft::libxc::ffi_xc::XC_MGGA_C_TPSSLOC
• dft::libxc::ffi_xc::XC_MGGA_C_VSXC
• dft::libxc::ffi_xc::XC_MGGA_K_CSK1
• dft::libxc::ffi_xc::XC_MGGA_K_CSK4
• dft::libxc::ffi_xc::XC_MGGA_K_CSK_LOC1
• dft::libxc::ffi_xc::XC_MGGA_K_CSK_LOC4
• dft::libxc::ffi_xc::XC_MGGA_K_GEA2
• dft::libxc::ffi_xc::XC_MGGA_K_GEA4
• dft::libxc::ffi_xc::XC_MGGA_K_L04
• dft::libxc::ffi_xc::XC_MGGA_K_L06
• dft::libxc::ffi_xc::XC_MGGA_K_PC07
• dft::libxc::ffi_xc::XC_MGGA_K_PC07_OPT
• dft::libxc::ffi_xc::XC_MGGA_K_PGSL025
• dft::libxc::ffi_xc::XC_MGGA_K_RDA
• dft::libxc::ffi_xc::XC_MGGA_XC_B97M_V
• dft::libxc::ffi_xc::XC_MGGA_XC_CC06
• dft::libxc::ffi_xc::XC_MGGA_XC_HLE17
• dft::libxc::ffi_xc::XC_MGGA_XC_LP90
• dft::libxc::ffi_xc::XC_MGGA_XC_OTPSS_D
• dft::libxc::ffi_xc::XC_MGGA_XC_TPSSLYP1W
• dft::libxc::ffi_xc::XC_MGGA_XC_ZLP
• dft::libxc::ffi_xc::XC_MGGA_X_2D_JS17
• dft::libxc::ffi_xc::XC_MGGA_X_2D_PRHG07
• dft::libxc::ffi_xc::XC_MGGA_X_2D_PRHG07_PRP10
• dft::libxc::ffi_xc::XC_MGGA_X_B00
• dft::libxc::ffi_xc::XC_MGGA_X_BJ06
• dft::libxc::ffi_xc::XC_MGGA_X_BLOC
• dft::libxc::ffi_xc::XC_MGGA_X_BR89
• dft::libxc::ffi_xc::XC_MGGA_X_BR89_1
• dft::libxc::ffi_xc::XC_MGGA_X_BR89_EXPLICIT
• dft::libxc::ffi_xc::XC_MGGA_X_BR89_EXPLICIT_1
• dft::libxc::ffi_xc::XC_MGGA_X_EDMGGA
• dft::libxc::ffi_xc::XC_MGGA_X_FT98
• dft::libxc::ffi_xc::XC_MGGA_X_GDME_0
• dft::libxc::ffi_xc::XC_MGGA_X_GDME_KOS
• dft::libxc::ffi_xc::XC_MGGA_X_GDME_NV
• dft::libxc::ffi_xc::XC_MGGA_X_GDME_VT
• dft::libxc::ffi_xc::XC_MGGA_X_GVT4
• dft::libxc::ffi_xc::XC_MGGA_X_GX
• dft::libxc::ffi_xc::XC_MGGA_X_HLTA
• dft::libxc::ffi_xc::XC_MGGA_X_JK
• dft::libxc::ffi_xc::XC_MGGA_X_LTA
• dft::libxc::ffi_xc::XC_MGGA_X_M05
• dft::libxc::ffi_xc::XC_MGGA_X_M05_2X
• dft::libxc::ffi_xc::XC_MGGA_X_M06
• dft::libxc::ffi_xc::XC_MGGA_X_M06_2X
• dft::libxc::ffi_xc::XC_MGGA_X_M06_HF
• dft::libxc::ffi_xc::XC_MGGA_X_M06_L
• dft::libxc::ffi_xc::XC_MGGA_X_M08_HX
• dft::libxc::ffi_xc::XC_MGGA_X_M08_SO
• dft::libxc::ffi_xc::XC_MGGA_X_M11
• dft::libxc::ffi_xc::XC_MGGA_X_M11_L
• dft::libxc::ffi_xc::XC_MGGA_X_MBEEF
• dft::libxc::ffi_xc::XC_MGGA_X_MBEEFVDW
• dft::libxc::ffi_xc::XC_MGGA_X_MBR
• dft::libxc::ffi_xc::XC_MGGA_X_MBRXC_BG
• dft::libxc::ffi_xc::XC_MGGA_X_MBRXH_BG
• dft::libxc::ffi_xc::XC_MGGA_X_MCML
• dft::libxc::ffi_xc::XC_MGGA_X_MGGAC
• dft::libxc::ffi_xc::XC_MGGA_X_MK00
• dft::libxc::ffi_xc::XC_MGGA_X_MK00B
• dft::libxc::ffi_xc::XC_MGGA_X_MN12_L
• dft::libxc::ffi_xc::XC_MGGA_X_MN12_SX
• dft::libxc::ffi_xc::XC_MGGA_X_MN15_L
• dft::libxc::ffi_xc::XC_MGGA_X_MODTPSS
• dft::libxc::ffi_xc::XC_MGGA_X_MS0
• dft::libxc::ffi_xc::XC_MGGA_X_MS1
• dft::libxc::ffi_xc::XC_MGGA_X_MS2
• dft::libxc::ffi_xc::XC_MGGA_X_MS2B
• dft::libxc::ffi_xc::XC_MGGA_X_MS2BS
• dft::libxc::ffi_xc::XC_MGGA_X_MS2_REV
• dft::libxc::ffi_xc::XC_MGGA_X_MTASK
• dft::libxc::ffi_xc::XC_MGGA_X_MVS
• dft::libxc::ffi_xc::XC_MGGA_X_MVSB
• dft::libxc::ffi_xc::XC_MGGA_X_MVSBS
• dft::libxc::ffi_xc::XC_MGGA_X_PBE_GX
• dft::libxc::ffi_xc::XC_MGGA_X_PKZB
• dft::libxc::ffi_xc::XC_MGGA_X_R2SCAN
• dft::libxc::ffi_xc::XC_MGGA_X_R2SCAN01
• dft::libxc::ffi_xc::XC_MGGA_X_R2SCANL
• dft::libxc::ffi_xc::XC_MGGA_X_R4SCAN
• dft::libxc::ffi_xc::XC_MGGA_X_REGTM
• dft::libxc::ffi_xc::XC_MGGA_X_REGTPSS
• dft::libxc::ffi_xc::XC_MGGA_X_REVM06_L
• dft::libxc::ffi_xc::XC_MGGA_X_REVSCAN
• dft::libxc::ffi_xc::XC_MGGA_X_REVSCANL
• dft::libxc::ffi_xc::XC_MGGA_X_REVTM
• dft::libxc::ffi_xc::XC_MGGA_X_REVTPSS
• dft::libxc::ffi_xc::XC_MGGA_X_RLDA
• dft::libxc::ffi_xc::XC_MGGA_X_RPP09
• dft::libxc::ffi_xc::XC_MGGA_X_RPPSCAN
• dft::libxc::ffi_xc::XC_MGGA_X_RSCAN
• dft::libxc::ffi_xc::XC_MGGA_X_RTPSS
• dft::libxc::ffi_xc::XC_MGGA_X_SA_TPSS
• dft::libxc::ffi_xc::XC_MGGA_X_SCAN
• dft::libxc::ffi_xc::XC_MGGA_X_SCANL
• dft::libxc::ffi_xc::XC_MGGA_X_TASK
• dft::libxc::ffi_xc::XC_MGGA_X_TAU_HCTH
• dft::libxc::ffi_xc::XC_MGGA_X_TB09
• dft::libxc::ffi_xc::XC_MGGA_X_TH
• dft::libxc::ffi_xc::XC_MGGA_X_TLDA
• dft::libxc::ffi_xc::XC_MGGA_X_TM
• dft::libxc::ffi_xc::XC_MGGA_X_TPSS
• dft::libxc::ffi_xc::XC_MGGA_X_VT84
• dft::libxc::ffi_xc::XC_NON_RELATIVISTIC
• dft::libxc::ffi_xc::XC_POLARIZED
• dft::libxc::ffi_xc::XC_RELATIVISTIC
• dft::libxc::ffi_xc::XC_TAU_EXPANSION
• dft::libxc::ffi_xc::XC_TAU_EXPLICIT
• dft::libxc::ffi_xc::XC_UNPOLARIZED
• utilities::DEBUG_PRINT