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In rest::dft::libxc::ffi_xc
Structs
func_params_type
func_reference_type
max_align_t
xc_dimensions
xc_func_info_type
xc_func_type
Constants
XC_CORRELATION
XC_EXCHANGE
XC_EXCHANGE_CORRELATION
XC_EXT_PARAMS_DEFAULT
XC_FAMILY_GGA
XC_FAMILY_HYB_GGA
XC_FAMILY_HYB_LDA
XC_FAMILY_HYB_MGGA
XC_FAMILY_LCA
XC_FAMILY_LDA
XC_FAMILY_MGGA
XC_FAMILY_OEP
XC_FAMILY_UNKNOWN
XC_FLAGS_1D
XC_FLAGS_2D
XC_FLAGS_3D
XC_FLAGS_DEVELOPMENT
XC_FLAGS_HAVE_ALL
XC_FLAGS_HAVE_EXC
XC_FLAGS_HAVE_FXC
XC_FLAGS_HAVE_KXC
XC_FLAGS_HAVE_LXC
XC_FLAGS_HAVE_VXC
XC_FLAGS_HYB_CAM
XC_FLAGS_HYB_CAMY
XC_FLAGS_HYB_LC
XC_FLAGS_HYB_LCY
XC_FLAGS_NEEDS_LAPLACIAN
XC_FLAGS_STABLE
XC_FLAGS_VV10
XC_GGA_C_ACGGA
XC_GGA_C_ACGGAP
XC_GGA_C_AM05
XC_GGA_C_APBE
XC_GGA_C_BCGP
XC_GGA_C_BGCP
XC_GGA_C_BMK
XC_GGA_C_CCDF
XC_GGA_C_CHACHIYO
XC_GGA_C_CS1
XC_GGA_C_FT97
XC_GGA_C_GAM
XC_GGA_C_GAPC
XC_GGA_C_GAPLOC
XC_GGA_C_HCTH_A
XC_GGA_C_HYB_TAU_HCTH
XC_GGA_C_LM
XC_GGA_C_LYP
XC_GGA_C_LYPR
XC_GGA_C_MGGAC
XC_GGA_C_N12
XC_GGA_C_N12_SX
XC_GGA_C_OPTC
XC_GGA_C_OP_B88
XC_GGA_C_OP_G96
XC_GGA_C_OP_PBE
XC_GGA_C_OP_PW91
XC_GGA_C_OP_XALPHA
XC_GGA_C_P86
XC_GGA_C_P86VWN
XC_GGA_C_P86VWN_FT
XC_GGA_C_P86_FT
XC_GGA_C_PBE
XC_GGA_C_PBEFE
XC_GGA_C_PBEINT
XC_GGA_C_PBELOC
XC_GGA_C_PBE_JRGX
XC_GGA_C_PBE_MOL
XC_GGA_C_PBE_SOL
XC_GGA_C_PBE_VWN
XC_GGA_C_PW91
XC_GGA_C_Q2D
XC_GGA_C_REGTPSS
XC_GGA_C_REVTCA
XC_GGA_C_RGE2
XC_GGA_C_SCAN_E0
XC_GGA_C_SG4
XC_GGA_C_SOGGA11
XC_GGA_C_SOGGA11_X
XC_GGA_C_SPBE
XC_GGA_C_TAU_HCTH
XC_GGA_C_TCA
XC_GGA_C_TM_LYP
XC_GGA_C_TM_PBE
XC_GGA_C_VPBE
XC_GGA_C_W94
XC_GGA_C_WI
XC_GGA_C_WI0
XC_GGA_C_WL
XC_GGA_C_XPBE
XC_GGA_C_ZPBEINT
XC_GGA_C_ZPBESOL
XC_GGA_C_ZVPBEINT
XC_GGA_C_ZVPBELOC
XC_GGA_C_ZVPBESOL
XC_GGA_K_ABSP1
XC_GGA_K_ABSP2
XC_GGA_K_ABSP3
XC_GGA_K_ABSP4
XC_GGA_K_ABSR1
XC_GGA_K_ABSR2
XC_GGA_K_APBE
XC_GGA_K_APBEINT
XC_GGA_K_BALTIN
XC_GGA_K_DK
XC_GGA_K_ERNZERHOF
XC_GGA_K_EXP4
XC_GGA_K_FR_B88
XC_GGA_K_FR_PW86
XC_GGA_K_GDS08
XC_GGA_K_GE2
XC_GGA_K_GHDS10
XC_GGA_K_GHDS10R
XC_GGA_K_GOLDEN
XC_GGA_K_GP85
XC_GGA_K_GR
XC_GGA_K_LC94
XC_GGA_K_LGAP
XC_GGA_K_LGAP_GE
XC_GGA_K_LIEB
XC_GGA_K_LKT
XC_GGA_K_LLP
XC_GGA_K_LUDENA
XC_GGA_K_MEYER
XC_GGA_K_OL1
XC_GGA_K_OL2
XC_GGA_K_PBE2
XC_GGA_K_PBE3
XC_GGA_K_PBE4
XC_GGA_K_PEARSON
XC_GGA_K_PERDEW
XC_GGA_K_PG1
XC_GGA_K_RATIONAL_P
XC_GGA_K_REVAPBE
XC_GGA_K_REVAPBEINT
XC_GGA_K_TFVW
XC_GGA_K_TFVW_OPT
XC_GGA_K_THAKKAR
XC_GGA_K_TKVLN
XC_GGA_K_TW1
XC_GGA_K_TW2
XC_GGA_K_TW3
XC_GGA_K_TW4
XC_GGA_K_VJKS
XC_GGA_K_VSK
XC_GGA_K_VT84F
XC_GGA_K_VW
XC_GGA_K_YT65
XC_GGA_XC_B97
XC_GGA_XC_B97_1
XC_GGA_XC_B97_2
XC_GGA_XC_B97_3
XC_GGA_XC_B97_D
XC_GGA_XC_B97_GGA1
XC_GGA_XC_B97_K
XC_GGA_XC_BEEFVDW
XC_GGA_XC_EDF1
XC_GGA_XC_HCTH_120
XC_GGA_XC_HCTH_147
XC_GGA_XC_HCTH_407
XC_GGA_XC_HCTH_407P
XC_GGA_XC_HCTH_93
XC_GGA_XC_HCTH_P14
XC_GGA_XC_HCTH_P76
XC_GGA_XC_HLE16
XC_GGA_XC_KT1
XC_GGA_XC_KT2
XC_GGA_XC_KT3
XC_GGA_XC_LB
XC_GGA_XC_MOHLYP
XC_GGA_XC_MOHLYP2
XC_GGA_XC_MPWLYP1W
XC_GGA_XC_NCAP
XC_GGA_XC_OBLYP_D
XC_GGA_XC_OPBE_D
XC_GGA_XC_OPWLYP_D
XC_GGA_XC_PBE1W
XC_GGA_XC_PBELYP1W
XC_GGA_XC_SB98_1a
XC_GGA_XC_SB98_1b
XC_GGA_XC_SB98_1c
XC_GGA_XC_SB98_2a
XC_GGA_XC_SB98_2b
XC_GGA_XC_SB98_2c
XC_GGA_XC_TH1
XC_GGA_XC_TH2
XC_GGA_XC_TH3
XC_GGA_XC_TH4
XC_GGA_XC_TH_FC
XC_GGA_XC_TH_FCFO
XC_GGA_XC_TH_FCO
XC_GGA_XC_TH_FL
XC_GGA_XC_VV10
XC_GGA_XC_WB97
XC_GGA_XC_WB97X
XC_GGA_XC_WB97X_D
XC_GGA_XC_WB97X_V
XC_GGA_XC_XLYP
XC_GGA_X_2D_B86
XC_GGA_X_2D_B86_MGC
XC_GGA_X_2D_B88
XC_GGA_X_2D_PBE
XC_GGA_X_AIRY
XC_GGA_X_AK13
XC_GGA_X_AM05
XC_GGA_X_APBE
XC_GGA_X_B86
XC_GGA_X_B86_MGC
XC_GGA_X_B86_R
XC_GGA_X_B88
XC_GGA_X_B88M
XC_GGA_X_B88_6311G
XC_GGA_X_BAYESIAN
XC_GGA_X_BCGP
XC_GGA_X_BEEFVDW
XC_GGA_X_BGCP
XC_GGA_X_BPCCAC
XC_GGA_X_C09X
XC_GGA_X_CAP
XC_GGA_X_CHACHIYO
XC_GGA_X_DK87_R1
XC_GGA_X_DK87_R2
XC_GGA_X_EB88
XC_GGA_X_ECMV92
XC_GGA_X_EV93
XC_GGA_X_FD_LB94
XC_GGA_X_FD_REVLB94
XC_GGA_X_FT97_A
XC_GGA_X_FT97_B
XC_GGA_X_G96
XC_GGA_X_GAM
XC_GGA_X_GG99
XC_GGA_X_HCTH_A
XC_GGA_X_HERMAN
XC_GGA_X_HJS_B88
XC_GGA_X_HJS_B88_V2
XC_GGA_X_HJS_B97X
XC_GGA_X_HJS_PBE
XC_GGA_X_HJS_PBE_SOL
XC_GGA_X_HTBS
XC_GGA_X_ITYH
XC_GGA_X_ITYH_OPTX
XC_GGA_X_ITYH_PBE
XC_GGA_X_KGG99
XC_GGA_X_KT1
XC_GGA_X_LAG
XC_GGA_X_LAMBDA_CH_N
XC_GGA_X_LAMBDA_LO_N
XC_GGA_X_LAMBDA_OC2_N
XC_GGA_X_LB
XC_GGA_X_LBM
XC_GGA_X_LG93
XC_GGA_X_LSPBE
XC_GGA_X_LSRPBE
XC_GGA_X_LV_RPW86
XC_GGA_X_MB88
XC_GGA_X_MPBE
XC_GGA_X_MPW91
XC_GGA_X_N12
XC_GGA_X_NCAP
XC_GGA_X_OL2
XC_GGA_X_OPTB86B_VDW
XC_GGA_X_OPTB88_VDW
XC_GGA_X_OPTPBE_VDW
XC_GGA_X_OPTX
XC_GGA_X_PBE
XC_GGA_X_PBEA
XC_GGA_X_PBEFE
XC_GGA_X_PBEINT
XC_GGA_X_PBEK1_VDW
XC_GGA_X_PBEPOW
XC_GGA_X_PBETRANS
XC_GGA_X_PBE_JSJR
XC_GGA_X_PBE_MOL
XC_GGA_X_PBE_R
XC_GGA_X_PBE_SOL
XC_GGA_X_PBE_TCA
XC_GGA_X_PBEpow
XC_GGA_X_PW86
XC_GGA_X_PW91
XC_GGA_X_PW91_MOD
XC_GGA_X_Q1D
XC_GGA_X_Q2D
XC_GGA_X_REVSSB_D
XC_GGA_X_RGE2
XC_GGA_X_RPBE
XC_GGA_X_RPW86
XC_GGA_X_S12G
XC_GGA_X_SFAT
XC_GGA_X_SFAT_PBE
XC_GGA_X_SG4
XC_GGA_X_SOGGA
XC_GGA_X_SOGGA11
XC_GGA_X_SSB
XC_GGA_X_SSB_D
XC_GGA_X_SSB_SW
XC_GGA_X_VMT84_GE
XC_GGA_X_VMT84_PBE
XC_GGA_X_VMT_GE
XC_GGA_X_VMT_PBE
XC_GGA_X_WC
XC_GGA_X_WPBEH
XC_GGA_X_XPBE
XC_HYB_GGA_XC_APBE0
XC_HYB_GGA_XC_APF
XC_HYB_GGA_XC_B1LYP
XC_HYB_GGA_XC_B1PW91
XC_HYB_GGA_XC_B1WC
XC_HYB_GGA_XC_B3LYP
XC_HYB_GGA_XC_B3LYP3
XC_HYB_GGA_XC_B3LYP5
XC_HYB_GGA_XC_B3LYPS
XC_HYB_GGA_XC_B3LYP_MCM1
XC_HYB_GGA_XC_B3LYP_MCM2
XC_HYB_GGA_XC_B3LYPs
XC_HYB_GGA_XC_B3P86
XC_HYB_GGA_XC_B3PW91
XC_HYB_GGA_XC_B5050LYP
XC_HYB_GGA_XC_B97
XC_HYB_GGA_XC_B97_1
XC_HYB_GGA_XC_B97_1P
XC_HYB_GGA_XC_B97_1p
XC_HYB_GGA_XC_B97_2
XC_HYB_GGA_XC_B97_3
XC_HYB_GGA_XC_B97_K
XC_HYB_GGA_XC_BHANDH
XC_HYB_GGA_XC_BHANDHLYP
XC_HYB_GGA_XC_BLYP35
XC_HYB_GGA_XC_CAMH_B3LYP
XC_HYB_GGA_XC_CAMY_B3LYP
XC_HYB_GGA_XC_CAMY_BLYP
XC_HYB_GGA_XC_CAMY_PBEH
XC_HYB_GGA_XC_CAM_B3LYP
XC_HYB_GGA_XC_CAM_O3LYP
XC_HYB_GGA_XC_CAM_PBEH
XC_HYB_GGA_XC_CAM_QTP_00
XC_HYB_GGA_XC_CAM_QTP_01
XC_HYB_GGA_XC_CAM_QTP_02
XC_HYB_GGA_XC_CAP0
XC_HYB_GGA_XC_CASE21
XC_HYB_GGA_XC_EDF2
XC_HYB_GGA_XC_HAPBE
XC_HYB_GGA_XC_HFLYP
XC_HYB_GGA_XC_HJS_B88
XC_HYB_GGA_XC_HJS_B97X
XC_HYB_GGA_XC_HJS_PBE
XC_HYB_GGA_XC_HJS_PBE_SOL
XC_HYB_GGA_XC_HPBEINT
XC_HYB_GGA_XC_HSE03
XC_HYB_GGA_XC_HSE06
XC_HYB_GGA_XC_HSE12
XC_HYB_GGA_XC_HSE12S
XC_HYB_GGA_XC_HSE_SOL
XC_HYB_GGA_XC_KMLYP
XC_HYB_GGA_XC_LB07
XC_HYB_GGA_XC_LCY_BLYP
XC_HYB_GGA_XC_LCY_PBE
XC_HYB_GGA_XC_LC_BLYP
XC_HYB_GGA_XC_LC_BLYPR
XC_HYB_GGA_XC_LC_BLYP_EA
XC_HYB_GGA_XC_LC_BOP
XC_HYB_GGA_XC_LC_PBEOP
XC_HYB_GGA_XC_LC_QTP
XC_HYB_GGA_XC_LC_VV10
XC_HYB_GGA_XC_LC_WPBE
XC_HYB_GGA_XC_LC_WPBE08_WHS
XC_HYB_GGA_XC_LC_WPBEH_WHS
XC_HYB_GGA_XC_LC_WPBESOL_WHS
XC_HYB_GGA_XC_LC_WPBE_WHS
XC_HYB_GGA_XC_LRC_WPBE
XC_HYB_GGA_XC_LRC_WPBEH
XC_HYB_GGA_XC_MB3LYP_RC04
XC_HYB_GGA_XC_MCAM_B3LYP
XC_HYB_GGA_XC_MPW1K
XC_HYB_GGA_XC_MPW1LYP
XC_HYB_GGA_XC_MPW1PBE
XC_HYB_GGA_XC_MPW1PW
XC_HYB_GGA_XC_MPW3LYP
XC_HYB_GGA_XC_MPW3PW
XC_HYB_GGA_XC_MPWLYP1M
XC_HYB_GGA_XC_O3LYP
XC_HYB_GGA_XC_PBE0_13
XC_HYB_GGA_XC_PBE38
XC_HYB_GGA_XC_PBE50
XC_HYB_GGA_XC_PBEB0
XC_HYB_GGA_XC_PBEH
XC_HYB_GGA_XC_PBE_2X
XC_HYB_GGA_XC_PBE_MOL0
XC_HYB_GGA_XC_PBE_MOLB0
XC_HYB_GGA_XC_PBE_SOL0
XC_HYB_GGA_XC_QTP17
XC_HYB_GGA_XC_RCAM_B3LYP
XC_HYB_GGA_XC_REVB3LYP
XC_HYB_GGA_XC_SB98_1A
XC_HYB_GGA_XC_SB98_1B
XC_HYB_GGA_XC_SB98_1C
XC_HYB_GGA_XC_SB98_1a
XC_HYB_GGA_XC_SB98_1b
XC_HYB_GGA_XC_SB98_1c
XC_HYB_GGA_XC_SB98_2A
XC_HYB_GGA_XC_SB98_2B
XC_HYB_GGA_XC_SB98_2C
XC_HYB_GGA_XC_SB98_2a
XC_HYB_GGA_XC_SB98_2b
XC_HYB_GGA_XC_SB98_2c
XC_HYB_GGA_XC_TUNED_CAM_B3LYP
XC_HYB_GGA_XC_WB97
XC_HYB_GGA_XC_WB97X
XC_HYB_GGA_XC_WB97X_D
XC_HYB_GGA_XC_WB97X_D3
XC_HYB_GGA_XC_WB97X_V
XC_HYB_GGA_XC_WC04
XC_HYB_GGA_XC_WHPBE0
XC_HYB_GGA_XC_WP04
XC_HYB_GGA_XC_X3LYP
XC_HYB_GGA_XC_mPW1K
XC_HYB_GGA_XC_mPW1PW
XC_HYB_GGA_X_CAM_S12G
XC_HYB_GGA_X_CAM_S12H
XC_HYB_GGA_X_N12_SX
XC_HYB_GGA_X_S12H
XC_HYB_GGA_X_SOGGA11_X
XC_HYB_LDA_XC_BN05
XC_HYB_LDA_XC_CAM_LDA0
XC_HYB_LDA_XC_LDA0
XC_HYB_MGGA_XC_B0KCIS
XC_HYB_MGGA_XC_B86B95
XC_HYB_MGGA_XC_B88B95
XC_HYB_MGGA_XC_B94_HYB
XC_HYB_MGGA_XC_B98
XC_HYB_MGGA_XC_BB1K
XC_HYB_MGGA_XC_EDMGGAH
XC_HYB_MGGA_XC_LC_TMLYP
XC_HYB_MGGA_XC_M08_HX
XC_HYB_MGGA_XC_M08_SO
XC_HYB_MGGA_XC_M11
XC_HYB_MGGA_XC_MPW1B95
XC_HYB_MGGA_XC_MPW1KCIS
XC_HYB_MGGA_XC_MPWB1K
XC_HYB_MGGA_XC_MPWKCIS1K
XC_HYB_MGGA_XC_PBE1KCIS
XC_HYB_MGGA_XC_PW6B95
XC_HYB_MGGA_XC_PW86B95
XC_HYB_MGGA_XC_PWB6K
XC_HYB_MGGA_XC_REVTPSSH
XC_HYB_MGGA_XC_TPSS0
XC_HYB_MGGA_XC_TPSS1KCIS
XC_HYB_MGGA_XC_TPSSH
XC_HYB_MGGA_XC_WB97M_V
XC_HYB_MGGA_XC_X1B95
XC_HYB_MGGA_XC_XB1K
XC_HYB_MGGA_X_BMK
XC_HYB_MGGA_X_DLDF
XC_HYB_MGGA_X_JS18
XC_HYB_MGGA_X_M05
XC_HYB_MGGA_X_M05_2X
XC_HYB_MGGA_X_M06
XC_HYB_MGGA_X_M06_2X
XC_HYB_MGGA_X_M06_HF
XC_HYB_MGGA_X_M06_SX
XC_HYB_MGGA_X_M08_HX
XC_HYB_MGGA_X_M08_SO
XC_HYB_MGGA_X_M11
XC_HYB_MGGA_X_MN12_SX
XC_HYB_MGGA_X_MN15
XC_HYB_MGGA_X_MS2H
XC_HYB_MGGA_X_MVSH
XC_HYB_MGGA_X_PJS18
XC_HYB_MGGA_X_REVM06
XC_HYB_MGGA_X_REVM11
XC_HYB_MGGA_X_REVSCAN0
XC_HYB_MGGA_X_SCAN0
XC_HYB_MGGA_X_TAU_HCTH
XC_KINETIC
XC_LDA_C_1D_CSC
XC_LDA_C_1D_LOOS
XC_LDA_C_2D_AMGB
XC_LDA_C_2D_PRM
XC_LDA_C_BR78
XC_LDA_C_CHACHIYO
XC_LDA_C_CHACHIYO_MOD
XC_LDA_C_GK72
XC_LDA_C_GL
XC_LDA_C_GOMBAS
XC_LDA_C_HL
XC_LDA_C_KARASIEV
XC_LDA_C_KARASIEV_MOD
XC_LDA_C_LP96
XC_LDA_C_LP_A
XC_LDA_C_LP_B
XC_LDA_C_MCWEENY
XC_LDA_C_ML1
XC_LDA_C_ML2
XC_LDA_C_OB_PW
XC_LDA_C_OB_PZ
XC_LDA_C_OW
XC_LDA_C_OW_LYP
XC_LDA_C_PK09
XC_LDA_C_PMGB06
XC_LDA_C_PW
XC_LDA_C_PW_MOD
XC_LDA_C_PW_RPA
XC_LDA_C_PZ
XC_LDA_C_PZ_MOD
XC_LDA_C_RC04
XC_LDA_C_RPA
XC_LDA_C_RPW92
XC_LDA_C_UPW92
XC_LDA_C_VBH
XC_LDA_C_VWN
XC_LDA_C_VWN_1
XC_LDA_C_VWN_2
XC_LDA_C_VWN_3
XC_LDA_C_VWN_4
XC_LDA_C_VWN_RPA
XC_LDA_C_W20
XC_LDA_C_WIGNER
XC_LDA_C_XALPHA
XC_LDA_C_vBH
XC_LDA_K_LP
XC_LDA_K_LP96
XC_LDA_K_TF
XC_LDA_K_ZLP
XC_LDA_X
XC_LDA_XC_1D_EHWLRG_1
XC_LDA_XC_1D_EHWLRG_2
XC_LDA_XC_1D_EHWLRG_3
XC_LDA_XC_CORRKSDT
XC_LDA_XC_GDSMFB
XC_LDA_XC_KSDT
XC_LDA_XC_LP_A
XC_LDA_XC_LP_B
XC_LDA_XC_TETER93
XC_LDA_XC_TIH
XC_LDA_XC_ZLP
XC_LDA_X_1D
XC_LDA_X_1D_EXPONENTIAL
XC_LDA_X_1D_SOFT
XC_LDA_X_2D
XC_LDA_X_ERF
XC_LDA_X_RAE
XC_LDA_X_REL
XC_LDA_X_SLOC
XC_LDA_X_YUKAWA
XC_MAX_REFERENCES
XC_MGGA_C_B88
XC_MGGA_C_B94
XC_MGGA_C_BC95
XC_MGGA_C_CC06
XC_MGGA_C_CS
XC_MGGA_C_DLDF
XC_MGGA_C_HLTAPW
XC_MGGA_C_KCIS
XC_MGGA_C_KCISK
XC_MGGA_C_LP90
XC_MGGA_C_M05
XC_MGGA_C_M05_2X
XC_MGGA_C_M06
XC_MGGA_C_M06_2X
XC_MGGA_C_M06_HF
XC_MGGA_C_M06_L
XC_MGGA_C_M06_SX
XC_MGGA_C_M08_HX
XC_MGGA_C_M08_SO
XC_MGGA_C_M11
XC_MGGA_C_M11_L
XC_MGGA_C_MN12_L
XC_MGGA_C_MN12_SX
XC_MGGA_C_MN15
XC_MGGA_C_MN15_L
XC_MGGA_C_PKZB
XC_MGGA_C_R2SCAN
XC_MGGA_C_R2SCAN01
XC_MGGA_C_R2SCANL
XC_MGGA_C_REVM06
XC_MGGA_C_REVM06_L
XC_MGGA_C_REVM11
XC_MGGA_C_REVSCAN
XC_MGGA_C_REVSCAN_VV10
XC_MGGA_C_REVTM
XC_MGGA_C_REVTPSS
XC_MGGA_C_RMGGAC
XC_MGGA_C_RPPSCAN
XC_MGGA_C_RREGTM
XC_MGGA_C_RSCAN
XC_MGGA_C_SCAN
XC_MGGA_C_SCANL
XC_MGGA_C_SCANL_RVV10
XC_MGGA_C_SCANL_VV10
XC_MGGA_C_SCAN_RVV10
XC_MGGA_C_SCAN_VV10
XC_MGGA_C_TM
XC_MGGA_C_TPSS
XC_MGGA_C_TPSSLOC
XC_MGGA_C_VSXC
XC_MGGA_K_CSK1
XC_MGGA_K_CSK4
XC_MGGA_K_CSK_LOC1
XC_MGGA_K_CSK_LOC4
XC_MGGA_K_GEA2
XC_MGGA_K_GEA4
XC_MGGA_K_L04
XC_MGGA_K_L06
XC_MGGA_K_PC07
XC_MGGA_K_PC07_OPT
XC_MGGA_K_PGSL025
XC_MGGA_K_RDA
XC_MGGA_XC_B97M_V
XC_MGGA_XC_CC06
XC_MGGA_XC_HLE17
XC_MGGA_XC_LP90
XC_MGGA_XC_OTPSS_D
XC_MGGA_XC_TPSSLYP1W
XC_MGGA_XC_ZLP
XC_MGGA_X_2D_JS17
XC_MGGA_X_2D_PRHG07
XC_MGGA_X_2D_PRHG07_PRP10
XC_MGGA_X_B00
XC_MGGA_X_BJ06
XC_MGGA_X_BLOC
XC_MGGA_X_BR89
XC_MGGA_X_BR89_1
XC_MGGA_X_BR89_EXPLICIT
XC_MGGA_X_BR89_EXPLICIT_1
XC_MGGA_X_EDMGGA
XC_MGGA_X_FT98
XC_MGGA_X_GDME_0
XC_MGGA_X_GDME_KOS
XC_MGGA_X_GDME_NV
XC_MGGA_X_GDME_VT
XC_MGGA_X_GVT4
XC_MGGA_X_GX
XC_MGGA_X_HLTA
XC_MGGA_X_JK
XC_MGGA_X_LTA
XC_MGGA_X_M05
XC_MGGA_X_M05_2X
XC_MGGA_X_M06
XC_MGGA_X_M06_2X
XC_MGGA_X_M06_HF
XC_MGGA_X_M06_L
XC_MGGA_X_M08_HX
XC_MGGA_X_M08_SO
XC_MGGA_X_M11
XC_MGGA_X_M11_L
XC_MGGA_X_MBEEF
XC_MGGA_X_MBEEFVDW
XC_MGGA_X_MBR
XC_MGGA_X_MBRXC_BG
XC_MGGA_X_MBRXH_BG
XC_MGGA_X_MCML
XC_MGGA_X_MGGAC
XC_MGGA_X_MK00
XC_MGGA_X_MK00B
XC_MGGA_X_MN12_L
XC_MGGA_X_MN12_SX
XC_MGGA_X_MN15_L
XC_MGGA_X_MODTPSS
XC_MGGA_X_MS0
XC_MGGA_X_MS1
XC_MGGA_X_MS2
XC_MGGA_X_MS2B
XC_MGGA_X_MS2BS
XC_MGGA_X_MS2_REV
XC_MGGA_X_MTASK
XC_MGGA_X_MVS
XC_MGGA_X_MVSB
XC_MGGA_X_MVSBS
XC_MGGA_X_PBE_GX
XC_MGGA_X_PKZB
XC_MGGA_X_R2SCAN
XC_MGGA_X_R2SCAN01
XC_MGGA_X_R2SCANL
XC_MGGA_X_R4SCAN
XC_MGGA_X_REGTM
XC_MGGA_X_REGTPSS
XC_MGGA_X_REVM06_L
XC_MGGA_X_REVSCAN
XC_MGGA_X_REVSCANL
XC_MGGA_X_REVTM
XC_MGGA_X_REVTPSS
XC_MGGA_X_RLDA
XC_MGGA_X_RPP09
XC_MGGA_X_RPPSCAN
XC_MGGA_X_RSCAN
XC_MGGA_X_RTPSS
XC_MGGA_X_SA_TPSS
XC_MGGA_X_SCAN
XC_MGGA_X_SCANL
XC_MGGA_X_TASK
XC_MGGA_X_TAU_HCTH
XC_MGGA_X_TB09
XC_MGGA_X_TH
XC_MGGA_X_TLDA
XC_MGGA_X_TM
XC_MGGA_X_TPSS
XC_MGGA_X_VT84
XC_NON_RELATIVISTIC
XC_POLARIZED
XC_RELATIVISTIC
XC_TAU_EXPANSION
XC_TAU_EXPLICIT
XC_UNPOLARIZED
Functions
xc_aux_func_ids
xc_aux_func_weights
xc_available_functional_names
xc_available_functional_numbers
xc_available_functional_numbers_by_name
xc_family_from_id
xc_func_alloc
xc_func_end
xc_func_free
xc_func_get_info
xc_func_info_get_ext_params_default_value
xc_func_info_get_ext_params_description
xc_func_info_get_ext_params_name
xc_func_info_get_family
xc_func_info_get_flags
xc_func_info_get_kind
xc_func_info_get_n_ext_params
xc_func_info_get_name
xc_func_info_get_number
xc_func_info_get_references
xc_func_init
xc_func_reference_get_bibtex
xc_func_reference_get_doi
xc_func_reference_get_ref
xc_func_set_dens_threshold
xc_func_set_ext_params
xc_func_set_ext_params_name
xc_func_set_sigma_threshold
xc_func_set_tau_threshold
xc_func_set_zeta_threshold
xc_functional_get_name
xc_functional_get_number
xc_gga
xc_gga_ak13_get_asymptotic
xc_gga_ak13_pars_get_asymptotic
xc_gga_exc
xc_gga_exc_vxc
xc_gga_exc_vxc_fxc
xc_gga_exc_vxc_fxc_kxc
xc_gga_fxc
xc_gga_kxc
xc_gga_lxc
xc_gga_vxc
xc_gga_vxc_fxc
xc_gga_vxc_fxc_kxc
xc_hyb_cam_coef
xc_hyb_exx_coef
xc_lda
xc_lda_exc
xc_lda_exc_vxc
xc_lda_exc_vxc_fxc
xc_lda_exc_vxc_fxc_kxc
xc_lda_fxc
xc_lda_kxc
xc_lda_lxc
xc_lda_vxc
xc_lda_vxc_fxc
xc_lda_vxc_fxc_kxc
xc_maximum_name_length
xc_mgga
xc_mgga_exc
xc_mgga_exc_vxc
xc_mgga_exc_vxc_fxc
xc_mgga_exc_vxc_fxc_kxc
xc_mgga_fxc
xc_mgga_kxc
xc_mgga_lxc
xc_mgga_vxc
xc_mgga_vxc_fxc
xc_mgga_vxc_fxc_kxc
xc_nlc_coef
xc_num_aux_funcs
xc_number_of_functionals
xc_reference
xc_reference_doi
xc_version
xc_version_string
Type Definitions
size_t
wchar_t
?
Constant
rest
::
dft
::
libxc
::
ffi_xc
::
XC_HYB_GGA_XC_LC_QTP
source
·
[
−
]
pub const XC_HYB_GGA_XC_LC_QTP:
u32
= 492;