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. 2021 Mar 30;125(13):2770–2781. doi: 10.1021/acs.jpca.1c02326

Figure 3.

Figure 3

Optimized structure (PBE/DZP) of benzene adsorbed on the {010} forsterite surface. The colored balls correspond to the following atoms: hydrogen (white), carbon (gray), magnesium (green), silicon (yellow), and oxygen (red). Atomic labels are reported on the corresponding atoms.