Double-Hybrid functionals available in PSI4
Name Description GGA? Meta? X_LRC? X_Hybrid? C_LRC? C_Hybrid? C_SCS? SS/OS Dispersion? Dispersion Description
B2GPPLYP B2GPPLYP Double Hybrid Exchange-Correlation Functional Y 0.650000 0.360000
B2GPPLYP-D3BJ B2GPPLYP Double Hybrid Exchange-Correlation Functional Y 0.650000 0.360000 Y  
B2GPPLYP-NL B2GPPLYP Double Hybrid Exchange-Correlation Functional Y 0.650000 0.360000
B2PLYP B2PLYP Double Hybrid Exchange-Correlation Functional Y 0.530000 0.270000
B2PLYP-D3BJ B2PLYP Double Hybrid Exchange-Correlation Functional Y 0.530000 0.270000 Y  
B2PLYP-D3MBJ B2PLYP Double Hybrid Exchange-Correlation Functional Y 0.530000 0.270000 Y  
B2PLYP-NL B2PLYP Double Hybrid Exchange-Correlation Functional Y 0.530000 0.270000
CORE-DSD-BLYP DSD-BLYP SCS Double Hybrid XC Functional (full-core param.) Y 0.690000 1.000000 0.370000 / 0.460000 Y  
CORE-DSD-BLYP-D3BJ DSD-BLYP SCS Double Hybrid XC Functional (full-core param.) Y 0.690000 1.000000 0.370000 / 0.460000 Y  
DSD-BLYP DSD-BLYP SCS Double Hybrid XC Functional (not dispersion corrected) Y 0.750000 1.000000 0.600000 / 0.460000
DSD-BLYP-D3BJ DSD-BLYP-D3BJ Dispersion-corrected SCS Double Hybrid XC Functional Y 0.710000 1.000000 0.400000 / 0.470000 Y  
DSD-BLYP-NL DSD-BLYP-NL (D3BJ,FC parameters) VV10 SCS Double Hybrid XC Functional Y 0.710000 1.000000 0.400000 / 0.470000
DSD-PBEB95 DSD-PBEB95 SCS Double Hybrid Meta-GGA XC Functional (not dispersion corrected) Y Y 0.690000 1.000000 0.220000 / 0.480000
DSD-PBEB95-D3BJ DSD-PBEB95-D3BJ Dispersion-corrected SCS Double Hybrid Meta-GGA XC Functional Y Y 0.660000 1.000000 0.090000 / 0.460000 Y  
DSD-PBEB95-NL DSD-PBEB95-NL (D3BJ parameters) VV10 SCS Double Hybrid Meta-GGA XC Functional Y Y 0.660000 1.000000 0.090000 / 0.460000
DSD-PBEP86 DSD-PBEP86 SCS Double Hybrid XC Functional (not dispersion corrected) Y 0.720000 1.000000 0.360000 / 0.510000
DSD-PBEP86-D3BJ DSD-PBEP86-D3BJ Dispersion-corrected SCS Double Hybrid XC Functional Y 0.690000 1.000000 0.220000 / 0.520000 Y  
DSD-PBEP86-NL DSD-PBEP86-NL (D3BJ parameters) VV10 SCS Double Hybrid XC Functional Y 0.690000 1.000000 0.220000 / 0.520000
DSD-PBEPBE DSD-PBEPBE SCS Double Hybrid XC Functional (not dispersion corrected) Y 0.720000 1.000000 0.310000 / 0.540000
DSD-PBEPBE-D3BJ DSD-PBEPBE-D3BJ Dispersion-corrected SCS Double Hybrid XC Functional Y 0.680000 1.000000 0.130000 / 0.550000 Y  
DSD-PBEPBE-NL DSD-PBEPBE-NL (D3BJ parameters) VV10 SCS Double Hybrid XC Functional Y 0.680000 1.000000 0.130000 / 0.550000
PBE0-2 PBE0-2 Double Hybrid Exchange-Correlation Functional Y 0.793701 0.500000
PBE0-DH PBE0-DH Double Hybrid Exchange-Correlation Functional Y 0.500000 0.125000 Y  
PTPSS PTPSS SOS Double Hybrid XC Functional Y Y 0.500000 1.000000 0.000000 / 0.375000
PTPSS-D3BJ PTPSS SOS Double Hybrid XC Functional Y Y 0.500000 1.000000 0.000000 / 0.375000 Y  
PWPB95 PWPB95 SOS Double Hybrid XC Functional Y Y 0.500000 1.000000 0.000000 / 0.269000
PWPB95-D3BJ PWPB95 SOS Double Hybrid XC Functional Y Y 0.500000 1.000000 0.000000 / 0.269000 Y  
PWPB95-NL PWPB95 SOS Double Hybrid XC Functional Y Y 0.500000 1.000000 0.000000 / 0.269000