Section SUBSYS

• a subsystem: coordinates, topology, molecules and cell

• Section path: CP2K_INPUT / FORCE_EVAL / SUBSYS

• This section cannot be repeated.

• Subsections

  • CELL
  • COLVAR
  • COORD
  • CORE_COORD
  • CORE_VELOCITY
  • KIND
  • MULTIPOLES
  • PRINT
  • RNG_INIT
  • SHELL_COORD
  • SHELL_VELOCITY
  • TOPOLOGY
  • VELOCITY

• Keywords

  • SEED

• Keyword descriptions

  SEED
  	SEED {Integer} ...
  	Initial seed for the (pseudo)random number generator for the Wiener process employed by the Langevin dynamics. Exactly 1 or 6 positive integer values are expected. A single value is replicated to fill up the full seed array with 6 numbers.
  	This keyword cannot be repeated and it expects a list of integers.
  	Default value: 12345