GGA_C_TM_PBE
Thakkar and McCarthy reparametrization [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]
- _B: real = 1.00000000E+000
Multiplies the A t^2 term. Used in the SPBE functional [Edit on GitHub]
- _BETA: real = -5.27280000E-002
beta constant [Edit on GitHub]
- _GAMMA: real = -1.56000000E-002
(1 - ln(2))/Pi^2 in the PBE [Edit on GitHub]