wB88_X |
B88 Short-Range GGA Exchange (HJS Model) |
Y |
— |
0.300000 |
— |
— |
— |
— |
— |
— |
wB97 |
Parameterized LRC B97 GGA XC Functional |
Y |
— |
0.400000 |
— |
— |
— |
— |
— |
— |
wB97X |
Parameterized Hybrid LRC B97 GGA XC Functional |
Y |
— |
0.400000 |
0.157706 |
— |
— |
— |
— |
— |
wB97X-2(LP) |
Double Hybrid LRC B97 GGA XC Functional (Large Pople parametrization) |
Y |
— |
0.300000 |
0.678792 |
— |
1.000000 |
0.581569 / 0.477992 |
— |
— |
wB97X-2(TQZ) |
Double Hybrid LRC B97 GGA XC Functional (TQZ parametrization) |
Y |
— |
0.300000 |
0.636158 |
— |
1.000000 |
0.529319 / 0.447105 |
— |
— |
wB97X-D |
Parameterized Hybrid LRC B97 GGA XC Functional with Dispersion |
Y |
— |
0.200000 |
0.222036 |
— |
— |
— |
-CHG |
Chai and Head-Gordon Dispersion Correction |
wBLYP |
BLYP SR-XC Functional (HJS Model) |
Y |
— |
0.300000 |
— |
— |
— |
— |
— |
— |
wPBE |
PBE SR-XC Functional (HJS Model) |
Y |
— |
0.400000 |
— |
— |
— |
— |
— |
— |
wPBE0 |
PBE0 SR-XC Functional (HJS Model) |
Y |
— |
0.300000 |
0.250000 |
— |
— |
— |
— |
— |
wPBE_X |
PBE Short-Range GGA Exchange (HJS Model) |
Y |
— |
0.300000 |
— |
— |
— |
— |
— |
— |
wPBEsol |
PBEsol SR-XC Functional (HJS Model) |
Y |
— |
0.400000 |
— |
— |
— |
— |
— |
— |
wPBEsol0 |
PBEsol0 SR-XC Functional (HJS Model) |
Y |
— |
0.300000 |
0.250000 |
— |
— |
— |
— |
— |
wPBEsol_X |
PBEsol Short-Range GGA Exchange (HJS Model) |
Y |
— |
0.300000 |
— |
— |
— |
— |
— |
— |
wSVWN |
LSDA SR-XC Functional |
— |
— |
0.300000 |
— |
— |
— |
— |
— |
— |
wS_X |
Slater Short-Range LSDA Exchange |
— |
— |
0.300000 |
— |
— |
— |
— |
— |
— |