Back to the main page of this manual | Input reference of CP2K version 2023.1 (Development Version) |
CP2K_INPUT /
FORCE_EVAL /
SUBSYS /
COLVAR /
DISTANCE
ATOMS {Integer} {Integer} |
|
Specifies the indexes of atoms/points defining the distance. [Edit on GitHub] | |
This keyword cannot be repeated and it expects precisely 2 integers. | |
Alias names for this keyword: POINTS |
AXIS {Keyword} |
|
Define the axes along which the colvar should be evaluated [Edit on GitHub] | |
This keyword cannot be repeated and it expects precisely one keyword. | |
Default value:
XYZ |
|
List of valid keywords:
|
SIGN {Logical} |
|
Whether the distance along one Cartesian axis has to be considered with sign. This option is valid if only one dimension is selected. [Edit on GitHub] | |
This keyword cannot be repeated and it expects precisely one logical. | |
The lone keyword behaves as a switch to
.TRUE. |
|
Default value:
.FALSE. |
Back to the main page of this manual or the CP2K home page | (Last update: 30.3.2023) |