Section DISTANCE

• Section to define the distance as a collective variables.

• Section path: CP2K_INPUT / FORCE_EVAL / SUBSYS / COLVAR / DISTANCE

• This section cannot be repeated and cannot be optional.

• Subsections

  • POINT

• Keywords

  • ATOMS
  • AXIS

• Keyword descriptions

  ATOMS
  	ATOMS {INTEGER} {INTEGER}
  	Specifies the indexes of atoms/points defining the distance.
  	This required keyword cannot be repeated and it expects precisely 2 integers.
  	Alias names for this keyword: POINTS

  AXIS
  	AXIS (XYZ | X | Y | Z | XY| XZ | YZ)
  	Define the axes along which the colvar should be evaluated
  	This optional keyword cannot be repeated and it expects precisely one keyword.
  	Default value: XYZ
  	List of valid keywords: X XY XYZ XZ Y YZ Z