GGA_C_N12

Minnesota N12 correlation functional [Edit on GitHub]

Keywords

SECTION_PARAMETERS
SCALE
_COS0
_COS1
_COS2
_COS3
_COS4
_CSS0
_CSS1
_CSS2
_CSS3
_CSS4

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]

_COS0: real = 1.00000000E+000: u^0 coefficient for opposite-spin correlation [Edit on GitHub]

_COS1: real = 3.24511000E+000: u^1 coefficient for opposite-spin correlation [Edit on GitHub]

_COS2: real = -2.52893000E+001: u^2 coefficient for opposite-spin correlation [Edit on GitHub]

_COS3: real = 1.44407000E+001: u^3 coefficient for opposite-spin correlation [Edit on GitHub]

_COS4: real = 1.96870000E+001: u^4 coefficient for opposite-spin correlation [Edit on GitHub]

_CSS0: real = 1.00000000E+000: u^0 coefficient for same-spin correlation [Edit on GitHub]

_CSS1: real = -5.53170000E+000: u^1 coefficient for same-spin correlation [Edit on GitHub]

_CSS2: real = 3.07958000E+001: u^2 coefficient for same-spin correlation [Edit on GitHub]

_CSS3: real = -5.64196000E+001: u^3 coefficient for same-spin correlation [Edit on GitHub]

_CSS4: real = 3.21250000E+001: u^4 coefficient for same-spin correlation [Edit on GitHub]