Section BETA

• beta spin

• Section path: CP2K_INPUT / FORCE_EVAL / SUBSYS / KIND / BS / BETA

• This section cannot be repeated.

• Subsections

  • none

• Keywords

  • L
  • N
  • NEL

• Keyword descriptions

  L
  	L {Integer} ...
  	Angular momentum quantum number of theorbitals of beta spin whose occupation is changed.Active only for unrestricted calculations
  	This keyword cannot be repeated and it expects a list of integers.
  	Default value: -1

  N
  	N {Integer} ...
  	Principal quantum number of theorbitals of beta spin whose occupation is changed. Default is the first not occupied.Active only for unrestricted calculations
  	This keyword cannot be repeated and it expects a list of integers.
  	Default value: 0

  NEL
  	NEL {Integer} ...
  	Orbital ccupation change per angular momentum quantum number.Applied to spin beta and active only in unrestricted calculations.
  	This keyword cannot be repeated and it expects a list of integers.
  	Default value: -1