MGGA_X_SCANL

Deorbitalized SCAN (SCAN-L) exchange [Edit on GitHub]

Keywords

• SECTION_PARAMETERS

• SCALE

• _A

• _B

• _C1

• _C2

• _D

• _K1

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 = 1.78472000E+000

pc07 a [Edit on GitHub]

_B: real = 2.58304000E-001

pc07 b [Edit on GitHub]

_C1: real = 6.67000000E-001

scan c1 [Edit on GitHub]

_C2: real = 8.00000000E-001

scan c2 [Edit on GitHub]

_D: real = 1.24000000E+000

scan d [Edit on GitHub]

_K1: real = 6.50000000E-002

scan k1 [Edit on GitHub]