Section HISTORY

• Section controling the history of visited minima and how minima are recognized at a later point.

• Section path: CP2K_INPUT / SWARM / GLOBAL_OPT / HISTORY

• This section cannot be repeated.

• Subsections

  • none

• Keywords

  • ENERGY_PRECISION
  • FINGERPRINT_PRECISION

• Keyword descriptions

  ENERGY_PRECISION
  	ENERGY_PRECISION {Real}
  	If the difference of two energies is below this threshold they are considert equal.
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.00000000E-05

  FINGERPRINT_PRECISION
  	FINGERPRINT_PRECISION {Real}
  	If the euclidean distance of two fingerprints is below this threshold, they are considert equal.
  	This keyword cannot be repeated and it expects precisely one real.
  	Default value: 1.00000000E-02