The CP2K project : input section ANGLE
Section
ANGLE
Index of all sections
. This section is located at
__ROOT__
%
FORCE_EVAL
%
SUBSYS
%
COLVAR
%
REACTION_PATH
%
COLVAR
%
ANGLE
.
Section to define the angle as a collective variables. This section can not be repeated and can not be optional.
Subsections
POINT
Section keywords
ATOMS
Keyword descriptions
ATOMS
ATOMS {integer} {integer} {integer}
Specifies the indexes of atoms/points defining the angle.
This required keyword expects precisely 3 integers
variants: POINTS
Back to the
CP2K homepage
or the latest version of
this manual