HYB_MGGA_X_M05_2X
Minnesota M05-2X hybrid exchange functional [Edit on GitHub]
Keywords
Keyword descriptions
- SECTION_PARAMETERS: logical = F
Lone keyword:
T
Activates the functional. [Edit on GitHub]
- SCALE: real = 1.00000000E+000
Scales this functional [Edit on GitHub]
- _A0: real = 1.00000000E+000
a0 parameter [Edit on GitHub]
- _A1: real = -5.68330000E-001
a1 parameter [Edit on GitHub]
- _A10: real = -1.32220500E+001
a10 parameter [Edit on GitHub]
- _A11: real = 1.52369400E+001
a11 parameter [Edit on GitHub]
- _A2: real = -1.30057000E+000
a2 parameter [Edit on GitHub]
- _A3: real = 5.50070000E+000
a3 parameter [Edit on GitHub]
- _A4: real = 9.06402000E+000
a4 parameter [Edit on GitHub]
- _A5: real = -3.22107500E+001
a5 parameter [Edit on GitHub]
- _A6: real = -2.37329800E+001
a6 parameter [Edit on GitHub]
- _A7: real = 7.02299600E+001
a7 parameter [Edit on GitHub]
- _A8: real = 2.98861400E+001
a8 parameter [Edit on GitHub]
- _A9: real = -6.02577800E+001
a9 parameter [Edit on GitHub]
- _CSI_HF: real = 4.40000000E-001
overall scaling for DFT part [Edit on GitHub]
- _CX: real = 5.60000000E-001
fraction of exact exchange [Edit on GitHub]