Table 1 Calculated inversion barrier of an oxygen atom at a SW defect through free-standing graphene as a function of the types of attached functional groups
From: Oxidation behavior of graphene-coated copper at intrinsic graphene defects of different origins
Functional group | Oxygen inversion barrier (eV) |
|---|---|
without | 2.461 |
1 H | 1.700 |
2 H | 1.573 |
1 OH | 1.484 |
2 OH | 1.502 |
1 O | 0.314 |
