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Figure 4
Ground-state projection in terms of crystal-field and LMCT configurations (a) and corresponding MO plots for Fe-3d based, t2 and e orbitals (b) for FeCl4−, reflecting the calculated DOC. The parameters used for the corresponding simulation are listed in Table 1[link].

Journal logoJOURNAL OF
SYNCHROTRON
RADIATION
ISSN: 1600-5775
Volume 23| Part 5| September 2016| Pages 1264-1271
https://doi.org/10.1107/S1600577516012443
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