Section SOC

• Is jet to be implemented

• Section path: CP2K_INPUT / FORCE_EVAL / PROPERTIES / TDDFPT / SOC

• This section cannot be repeated.

• Subsections

  • none

• Keywords

  • EPS_FILTER
  • GRID

• Keyword descriptions

  EPS_FILTER
  	EPS_FILTER {Real}
  	The threshold used for sparse matrix operations
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.00000000E-010
  	Alias names for this keyword: EPS_FILTER_MATRIX

  GRID
  	GRID {Word} {Word} {Word}
  	Specification of the atomic angular and radial grids for a atomic kind. This keyword must be repeated for all kinds! Usage: GRID < LEBEDEV_GRID > < RADIAL_GRID >
  	This keyword can be repeated and it expects precisely 3 words.
  	Alias names for this keyword: ATOMIC_GRID