Add magnetic_moments field to InputDoc
#945
Merged
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Added a
magnetic_moments
field to theInputDoc
class.This is instantiated from
parameters["MAGMOM"]
.This is a necessary change to support a common magnetic orderings workflow in atomate2. See discussion in the open PR: materialsproject/atomate2#432
Tagging @utf
Contributor Checklist
^ (no tests needed here)