M05 |
Heavily Parameterized Hybrid Meta-GGA XC Functional |
Y |
Y |
— |
0.280000 |
— |
— |
— |
— |
— |
M05-2X |
Heavily Parameterized Hybrid Meta-GGA XC Functional |
Y |
Y |
— |
0.560000 |
— |
— |
— |
— |
— |
M05-2X-D3 |
Heavily Parameterized Hybrid Meta-GGA XC Functional |
Y |
Y |
— |
0.560000 |
— |
— |
— |
-D3ZERO |
Grimme’s -D3 (zero-damping) Dispersion Correction |
M05-D3 |
Heavily Parameterized Hybrid Meta-GGA XC Functional |
Y |
Y |
— |
0.280000 |
— |
— |
— |
-D3ZERO |
Grimme’s -D3 (zero-damping) Dispersion Correction |
dlDF |
Dispersionless Hybrid Meta-GGA XC Functional |
Y |
Y |
— |
0.614413 |
— |
— |
— |
— |
— |
dlDF+D |
Dispersionless Hybrid Meta-GGA XC Functional |
Y |
Y |
— |
0.614413 |
— |
— |
— |
-DAS2010 |
Podeszwa and Szalewicz Dispersion Correction |
dlDF+D09 |
Dispersionless Hybrid Meta-GGA XC Functional |
Y |
Y |
— |
0.614413 |
— |
— |
— |
-DAS2009 |
Podeszwa and Szalewicz Dispersion Correction |