HYB_MGGA_X_M06_2X
Minnesota M06-2X 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 = 4.60000000E-001
a0 parameter [Edit on GitHub]
- _A1: real = -2.20605200E-001
a1 parameter [Edit on GitHub]
- _A10: real = 1.52280800E+001
a10 parameter [Edit on GitHub]
- _A11: real = 1.52222700E+001
a11 parameter [Edit on GitHub]
- _A2: real = -9.43178800E-002
a2 parameter [Edit on GitHub]
- _A3: real = 2.16449400E+000
a3 parameter [Edit on GitHub]
- _A4: real = -2.55646600E+000
a4 parameter [Edit on GitHub]
- _A5: real = -1.42213300E+001
a5 parameter [Edit on GitHub]
- _A6: real = 1.55504400E+001
a6 parameter [Edit on GitHub]
- _A7: real = 3.59807800E+001
a7 parameter [Edit on GitHub]
- _A8: real = -2.72275400E+001
a8 parameter [Edit on GitHub]
- _A9: real = -3.92409300E+001
a9 parameter [Edit on GitHub]
- _CSI_HF: real = 1.00000000E+000
overall scaling for DFT part [Edit on GitHub]
- _CX: real = 5.40000000E-001
fraction of exact exchange [Edit on GitHub]