The CP2K project : input section MAPPING
Section MAPPING
Index of all sections. This section is located at
__ROOT__%FORCE_EVAL%MIXED%MAPPING.
Defines the mapping of atoms for the different force_eval with the mixed force_eval. The default is to have a mapping 1-1 between atom index (i.e. all force_eval share the same geometrical structure). The mapping is based on defining fragments and the mapping the fragments between the several force_eval and the mixed force_eval. This section can be repeated and can not be optional.
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