PAS for Fe

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    Jeroen Wouters
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    We start by discussing the FeI position. This ion has no rotation axes. There is no PAS for this ion at this position.

    Next, we look to the FeII positions. The FeIIa ion has only one 2-fold rotation axis (going from FeIIa through N to the FeIIa ion on the other side). This axis is chosen as the z-axis of the PAS.
    The FeIIb ion has a 4-fold rotation axis (connecting the 2 FeIIb ions). This axis is chosen as the z-axis of the PAS. Additionally, one knows that \eta will be zero.

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