GGA_K_RATIONAL_P

RATIONAL$^{p}$ by Lehtomaki and Lopez-Acevedo (by default $p=3/2$, $C_{2}=0.7687$) [Edit on GitHub]

Keywords

• SECTION_PARAMETERS

• SCALE

• _C2

• _P

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]

_C2: real = 7.68700000E-001

Coefficient for s^2 [Edit on GitHub]

_P: real = 1.50000000E+000

Exponent [Edit on GitHub]