LDA_C_PW_RPA
Perdew & Wang (fit to the RPA energy) [Edit on GitHub]
Keywords
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]
- _ALPHA1_0: real = 8.24770000E-002
alpha10 [Edit on GitHub]
- _ALPHA1_1: real = 3.53740000E-002
alpha11 [Edit on GitHub]
- _ALPHA1_2: real = 2.88290000E-002
alpha12 [Edit on GitHub]
- _A_0: real = 3.10910000E-002
a0 [Edit on GitHub]
- _A_1: real = 1.55450000E-002
a1 [Edit on GitHub]
- _A_2: real = 1.68870000E-002
a2 [Edit on GitHub]
- _BETA1_0: real = 5.14860000E+000
beta10 [Edit on GitHub]
- _BETA1_1: real = 6.48690000E+000
beta11 [Edit on GitHub]
- _BETA1_2: real = 1.03570000E+001
beta12 [Edit on GitHub]
- _BETA2_0: real = 1.64830000E+000
beta20 [Edit on GitHub]
- _BETA2_1: real = 1.30830000E+000
beta21 [Edit on GitHub]
- _BETA2_2: real = 3.62310000E+000
beta22 [Edit on GitHub]
- _BETA3_0: real = 2.36470000E-001
beta30 [Edit on GitHub]
- _BETA3_1: real = 1.51800000E-001
beta31 [Edit on GitHub]
- _BETA3_2: real = 4.79900000E-001
beta32 [Edit on GitHub]
- _BETA4_0: real = 2.06140000E-001
beta40 [Edit on GitHub]
- _BETA4_1: real = 8.23490000E-002
beta41 [Edit on GitHub]
- _BETA4_2: real = 1.22790000E-001
beta42 [Edit on GitHub]
- _FZ20: real = 1.70992100E+000
fz20 [Edit on GitHub]
- _PP_0: real = 7.50000000E-001
pp0 [Edit on GitHub]
- _PP_1: real = 7.50000000E-001
pp1 [Edit on GitHub]
- _PP_2: real = 1.00000000E+000
pp2 [Edit on GitHub]