Section LDA_C_KARASIEV

• Karasiev reparameterization of Chachiyo

• Section path: CP2K_INPUT / FORCE_EVAL / PROPERTIES / TDDFPT / XC / XC_FUNCTIONAL / LDA_C_KARASIEV

• This section cannot be repeated.

• Subsections

  • none

• Keywords

  • SECTION_PARAMETERS
  • SCALE
  • _AF
  • _AP
  • _BF
  • _BP

• Keyword descriptions

  SECTION_PARAMETERS
  	&LDA_C_KARASIEV {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

  _AF
  	_AF {Real}
  	af parameter
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -7.77267500E-003

  _AP
  	_AP {Real}
  	ap parameter
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -1.55453500E-002

  _BF
  	_BF {Real}
  	bf parameter
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 2.83559732E+001

  _BP
  	_BP {Real}
  	bp parameter
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 2.17392245E+001