Section LDA_C_LP96

• Liu-Parr correlation  [Edit on GitHub]

• Section path: CP2K_INPUT / ATOM / METHOD / XC / XC_FUNCTIONAL / LDA_C_LP96

• This section cannot be repeated.

• Subsections

  • none

• Keywords

  • SECTION_PARAMETERS
  • SCALE
  • _C1
  • _C2
  • _C3

• Keyword descriptions

  SECTION_PARAMETERS
  	&LDA_C_LP96 {Logical}
  	Activates the functional.  [Edit on GitHub]
  	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  [Edit on GitHub]
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.00000000E+000

  _C1
  	_C1 {Real}
  	C1 parameter  [Edit on GitHub]
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -6.03000000E-002

  _C2
  	_C2 {Real}
  	C2 parameter  [Edit on GitHub]
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.75000000E-002

  _C3
  	_C3 {Real}
  	C3 parameter  [Edit on GitHub]
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: -5.30000000E-004