LDA_C_PZ_MOD

Perdew & Zunger (Modified) [Edit on GitHub]

Keywords

SECTION_PARAMETERS
SCALE
_A0
_A1
_B0
_B1
_BETA10
_BETA11
_BETA20
_BETA21
_C0
_C1
_D0
_D1
_GAMMA0
_GAMMA1

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]

_A0: real = 3.11000000E-002: a0 parameter [Edit on GitHub]

_A1: real = 1.55500000E-002: a1 parameter [Edit on GitHub]

_B0: real = -4.80000000E-002: b0 parameter [Edit on GitHub]

_B1: real = -2.69000000E-002: b1 parameter [Edit on GitHub]

_BETA10: real = 1.05290000E+000: beta10 parameter [Edit on GitHub]

_BETA11: real = 1.39810000E+000: beta11 parameter [Edit on GitHub]

_BETA20: real = 3.33400000E-001: beta20 parameter [Edit on GitHub]

_BETA21: real = 2.61100000E-001: beta21 parameter [Edit on GitHub]

_C0: real = 2.01915194E-003: c0 parameter [Edit on GitHub]

_C1: real = 6.92551213E-004: c1 parameter [Edit on GitHub]

_D0: real = -1.16320664E-002: d0 parameter [Edit on GitHub]

_D1: real = -4.80126354E-003: d1 parameter [Edit on GitHub]

_GAMMA0: real = -1.42300000E-001: gamma0 parameter [Edit on GitHub]

_GAMMA1: real = -8.43000000E-002: gamma1 parameter [Edit on GitHub]