HYB_MGGA_X_TAU_HCTH
Hybrid version of tau-HCTH [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]
- _AX: real = 1.50000000E-001
Fraction of exact exchange [Edit on GitHub]
- _CXL0: real = 8.67350000E-001
Local exchange, u^0 coefficient [Edit on GitHub]
- _CXL1: real = 3.00800000E-001
Local exchange, u^1 coefficient [Edit on GitHub]
- _CXL2: real = 1.22080000E+000
Local exchange, u^2 coefficient [Edit on GitHub]
- _CXL3: real = 1.57400000E-001
Local exchange, u^3 coefficient [Edit on GitHub]
- _CXNL0: real = -2.30000000E-003
Non-local exchange, u^0 coefficient [Edit on GitHub]
- _CXNL1: real = -2.84900000E-001
Non-local exchange, u^1 coefficient [Edit on GitHub]
- _CXNL2: real = 5.41460000E+000
Non-local exchange, u^2 coefficient [Edit on GitHub]
- _CXNL3: real = -1.09090000E+001
Non-local exchange, u^3 coefficient [Edit on GitHub]