Section MGGA_C_M08_HX

• Minnesota M08 correlation functional

• Section path: CP2K_INPUT / ATOM / METHOD / XC / XC_FUNCTIONAL / MGGA_C_M08_HX

• This section cannot be repeated.

• Subsections

  • none

• Keywords

  • SECTION_PARAMETERS
  • SCALE
  • _A0
  • _A1
  • _A10
  • _A11
  • _A2
  • _A3
  • _A4
  • _A5
  • _A6
  • _A7
  • _A8
  • _A9
  • _B0
  • _B1
  • _B10
  • _B11
  • _B2
  • _B3
  • _B4
  • _B5
  • _B6
  • _B7
  • _B8
  • _B9

• Keyword descriptions

  SECTION_PARAMETERS
  	&MGGA_C_M08_HX {Logical}
  	Activates the functional.
  	This keyword cannot be repeated and it expects precisely one logical.
  	The lone keyword behaves as a switch to .TRUE.
  	Default value: .FALSE.

  SCALE
  	SCALE {Real}
  	Scales this functional
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.00000000E+000

  _A0
  	_A0 {Real}
  	a0
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.00000000E+000

  _A1
  	_A1 {Real}
  	a1
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -4.06613870E-001

  _A10
  	_A10 {Real}
  	a10
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -1.12974030E+002

  _A11
  	_A11 {Real}
  	a11
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 3.36293120E+002

  _A2
  	_A2 {Real}
  	a2
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -3.32325300E+000

  _A3
  	_A3 {Real}
  	a3
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.55409800E+000

  _A4
  	_A4 {Real}
  	a4
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 4.42480330E+001

  _A5
  	_A5 {Real}
  	a5
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -8.43519300E+001

  _A6
  	_A6 {Real}
  	a6
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -1.19555810E+002

  _A7
  	_A7 {Real}
  	a7
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 3.91470810E+002

  _A8
  	_A8 {Real}
  	a8
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.83638510E+002

  _A9
  	_A9 {Real}
  	a9
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -6.32682230E+002

  _B0
  	_B0 {Real}
  	b0
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.38123340E+000

  _B1
  	_B1 {Real}
  	b1
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -2.46838060E+000

  _B10
  	_B10 {Real}
  	b10
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -4.34308130E+002

  _B11
  	_B11 {Real}
  	b11
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 5.66279640E+001

  _B2
  	_B2 {Real}
  	b2
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -1.19015010E+001

  _B3
  	_B3 {Real}
  	b3
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -5.41126670E+001

  _B4
  	_B4 {Real}
  	b4
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.00558460E+001

  _B5
  	_B5 {Real}
  	b5
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.48006870E+002

  _B6
  	_B6 {Real}
  	b6
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.15614200E+002

  _B7
  	_B7 {Real}
  	b7
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 2.55918150E+002

  _B8
  	_B8 {Real}
  	b8
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 2.13207720E+002

  _B9
  	_B9 {Real}
  	b9
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -4.84120670E+002