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]