CENTER_COORDINATES

Allows centering the coordinates of the system in the box. The centering point can be defined by the user. [Edit on GitHub]

Keywords

• SECTION_PARAMETERS

• CENTER_POINT

Keyword descriptions

SECTION_PARAMETERS: logical = F

Lone keyword: T

Usage: &CENTER_COORDINATES T

Controls the activation of the centering method [Edit on GitHub]

CENTER_POINT: real[3]

Specify the point used for centering the coordinates. Default is to center the system in cell/2. [Edit on GitHub]