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. 2022 Apr 1;12(17):10321–10335. doi: 10.1039/d2ra00185c

Adsorption energy parameters of the stable configuration system (all units in kcal mol−1).

Systems Adsorption energy of inhibitor Adsorption energy of water molecules
Al (111)/OXM/150H2O −2359 −11
Al (111)/TET/150H2O −2376 −10