GGA_K_PBE3

Three parameter PBE-like expansion [Edit on GitHub]

Keywords

• SECTION_PARAMETERS

• SCALE

• _A

• _C1

• _C2

• _C3

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]

_A: real = 4.13550000E+000

a [Edit on GitHub]

_C1: real = -3.74250000E+000

c1 [Edit on GitHub]

_C2: real = 5.02580000E+001

c2 [Edit on GitHub]

_C3: real = 0.00000000E+000

c3 [Edit on GitHub]