Skip to main content
. 2018 Oct 8;8(60):34350–34358. doi: 10.1039/c8ra01336e

Fig. 5. Active orbital occupation numbers (HOMO−8, …, HOMO−1, HOMO, LUMO, LUMO+1, …, and LUMO+8) for the lowest singlet state of n-coronene, obtained with spin-restricted TAO-LDA. For brevity, HOMO is denoted as H, LUMO is denoted as L, and so on.

Fig. 5