As the value for full occupancy for LHPM/Rietica depends on the site multiplicity (same goes for DBWS, Fullprof, RIET7, Shelx). This can make it quite tedious setting up a structure from scratch. However, in the LHPM/Rietica GUI, this can be set quite easily. |
With the mouse curser over the atom information; click on the right mouse button where you are presented with the ability to set full occupancies in the resulting menu options.
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