GGA_X_SSB_D

Swart, Sola and Bickelhaupt dispersion [Edit on GitHub]

Keywords

SECTION_PARAMETERS
SCALE
_A
_B
_C
_D
_DELTA
_E
_F
_U

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 = 1.07996600E+000: A, Constant s limit [Edit on GitHub]

_B: real = 1.97465000E-001: B in B s^2/(1 + C s^2) [Edit on GitHub]

_C: real = 2.72729000E-001: C in B s^2/(1 + C s^2) [Edit on GitHub]

_D: real = 1.97465000E-001: D in D s^2/(1 + E s^4) [Edit on GitHub]

_DELTA: real = 1.00000000E-001: delta, KT parameter [Edit on GitHub]

_E: real = 5.87364500E+000: E in D s^2/(1 + E s^4) [Edit on GitHub]

_F: real = 9.49488000E-001: F, prefactor for KT term [Edit on GitHub]

_U: real = -7.49940000E-001: u, reweighting of KT and SSB terms [Edit on GitHub]