Fig. 3
From: Probing atomic-scale processes at the ferrihydrite-water interface with reactive molecular dynamics
Surface charge analysis of Fh: impacts of \({\text {[Mo]}_{\text{aq}}}\) adsorption on surface charge distribution. A Charge probability distribution of Fh in Mo-0 and Mo-8. B Calculated surface charge as a function of the number of \({\text {[Mo]}_{\text{aq}}}\). C Calculated equilibrium atomic charge difference between Mo-0 and Mo-8. Circled areas show the spots with the highest charge perturbations