Table 3 Calculated surface energies of Au(100), (111), and (110) surface with and without the adsorption of OXCA
Surface | (100) | (111) | (110) | Δ φ (100)–(111) | Diff (%) |
---|---|---|---|---|---|
E Surf _c l e a n | 0.325 | 0.284 | 0.567 | 0.041 | |
E Surf _O X C A | 0.310 | 0.276 | 0.549 | 0.034 | 17 |
Surface | (100) | (111) | (110) | Δ φ (100)–(111) | Diff (%) |
---|---|---|---|---|---|
E Surf _c l e a n | 0.325 | 0.284 | 0.567 | 0.041 | |
E Surf _O X C A | 0.310 | 0.276 | 0.549 | 0.034 | 17 |