GGA_X_ITYH_PBE
Short-range recipe for PBE functional [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]
- _KAPPA: real = 8.04000000E-001
Asymptotic value of the enhancement function [Edit on GitHub]
- _MU: real = 2.19514973E-001
Coefficient of the 2nd order expansion [Edit on GitHub]
- _OMEGA: real = 3.30000000E-001
Range-separation parameter [Edit on GitHub]