The CP2K project : input section CHARGE
Section
CHARGE
Index of all sections
. This section is located at
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FORCE_EVAL
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MM
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FORCEFIELD
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CHARGE
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This section specifies the charge of the MM atoms. This section can be repeated and can not be optional.
Subsections
None
Section keywords
ATOM
CHARGE
Keyword descriptions
ATOM
ATOM {KIND1}
Defines the atomic kind of the charge.
This required keyword expects a word
CHARGE
CHARGE {real}
Defines the charge of the MM atom in electron charge unit.
This required keyword expects a real
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