The CP2K project : input section TORSION
Section
TORSION
Index of all sections
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FORCE_EVAL
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SUBSYS
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COLVAR
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COMBINE_COLVAR
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COLVAR
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TORSION
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Section to define the torsion 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} {integer}
Specifies the indexes of atoms/points defining the torsion.
This required keyword expects precisely 4 integers
variants: POINTS
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