Section GGA_C_TM_LYP

• Takkar and McCarthy reparametrization  [Edit on GitHub]

• Section path: CP2K_INPUT / FORCE_EVAL / DFT / XAS_TDP / KERNEL / XC_FUNCTIONAL / GGA_C_TM_LYP

• This section cannot be repeated.

• Subsections

  • none

• Keywords

  • SECTION_PARAMETERS
  • SCALE
  • _A
  • _B
  • _C
  • _D

• Keyword descriptions

  SECTION_PARAMETERS
  	&GGA_C_TM_LYP {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

  _A
  	_A {Real}
  	Parameter a of LYP  [Edit on GitHub]
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 3.93000000E-002

  _B
  	_B {Real}
  	Parameter b of LYP  [Edit on GitHub]
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 2.10000000E-001

  _C
  	_C {Real}
  	Parameter c of LYP  [Edit on GitHub]
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 4.10000000E-001

  _D
  	_D {Real}
  	Parameter d of LYP  [Edit on GitHub]
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.50000000E-001