MGGA_C_TPSS_GAUSSIAN

Tao, Perdew, Staroverov & Scuseria with parameters from Gaussian [Edit on GitHub]

Keywords

• SECTION_PARAMETERS

• SCALE

• _BETA

• _C0_C0

• _C0_C1

• _C0_C2

• _C0_C3

• _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]

_BETA: real = 6.67263212E-002

beta [Edit on GitHub]

_C0_C0: real = 5.30000000E-001

C0_c0 [Edit on GitHub]

_C0_C1: real = 8.70000000E-001

C0_c1 [Edit on GitHub]

_C0_C2: real = 5.00000000E-001

C0_c2 [Edit on GitHub]

_C0_C3: real = 2.26000000E+000

C0_c3 [Edit on GitHub]

_D: real = 2.80000000E+000

d [Edit on GitHub]