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. 2022 Oct 3;13(40):9348–9354. doi: 10.1021/acs.jpclett.2c02186

Table 2. Adsorption Energies (in eV per molecule) for Different Ligands at Different Coverages onto the NP.

Eads(eV/molecule) AA MPA CAT SIL ETH
corner–low coverage –2.98a –5.71 –3.91 –4.62 –2.32
corner–high coverage –3.00 –3.85 –2.66 –3.00 –1.60
surface–high coverage –2.44 –3.66 –2.55 –2.92 –1.57
a

This value is taken from ref (32).