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. 2022 Nov 9;12(22):3943. doi: 10.3390/nano12223943

Figure 7.

Figure 7

Real-space representation of active TAO-orbitals, such as H − 5 (1.987), H − 4 (1.983), H − 3 (1.964), H − 2 (1.964), H − 1 (1.958), H (1.958), L (0.043), L + 1 (0.043), L + 2 (0.035), L + 3 (0.034), L + 4 (0.020), and L + 5 (0.011), of ground-state 5-HGQR, obtained from spin-restricted TAO-LDA, at isovalue = 0.02 e/Å3. The TOONs are given in parentheses.