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. 2016 Sep 29;7:12884. doi: 10.1038/ncomms12884

Figure 7. Kohn–Sham molecular orbital representations of the principal Th–P interactions of 3.

Figure 7

HOMO−1 (a, −0.394 eV) and HOMO (b, −0.374 eV) represent the two principal thorium–phosphorus covalent σ- and π-bonding interactions in the anion component of 3.