fig4
Figure 4. DFT calculation of the Zn/Mo DSAC-SMA. (A) Suggested reaction process for POD-like nanozymes. (B-D) Computational models and optimized hydroxyl adsorption configurations at the active sites of (B) Zn-SAC, (C) Mo-SAC, and (D) Zn/Mo DSAC-SMA. Reproduced with permission from Ref.[45] Copyright 2022, John Wiley and Sons.
