HYB_GGA_XC_MB3LYP_RC04

B3LYP with RC04 LDA [Edit on GitHub]

Keywords

SECTION_PARAMETERS
SCALE
_A0
_AC
_AX
_D

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 = 2.00000000E-001: Fraction of exact exchange [Edit on GitHub]

_AC: real = 8.10000000E-001: Fraction of GGA correlation correction [Edit on GitHub]

_AX: real = 7.20000000E-001: Fraction of GGA exchange correction [Edit on GitHub]

_D: real = 5.70000000E-001: Correction factor for RC04 part [Edit on GitHub]