The CP2K project : input section DIMER_VECTOR
Section
DIMER_VECTOR
Index of all sections
. This section is located at
__ROOT__
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MOTION
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GEO_OPT
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TRANSITION_STATE
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DIMER
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DIMER_VECTOR
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Specifies the initial dimer vector (used frequently to restart DIMER calculations). If not provided the starting orientation of the dimer is chosen randomly. This section can not be repeated and can be optional.
Subsections
None
Section keywords
_DEFAULT_KEYWORD_
Keyword descriptions
_DEFAULT_KEYWORD_
Specify on each line the components of the dimer vector.
This optional keyword expects a list of reals, and may repeat
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