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I checked it, and it does work. But we also want the option to determine the magnetic ordering based on only certain elements. For example, for Fe3Pt, we may want to determine the magnetic ordering based only on the Fe atoms.
nhew1994
changed the title
BUG: the determine_magnetic_ordering function in the magnetism module sometimes assigns FiM to SF configurations
ENH: the determine_magnetic_ordering function in the magnetism module sometimes assigns FiM to SF configurations
Nov 6, 2024
Based on some of my results for Fe3Pt.
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