fig3
Figure 3. Theoretical calculation results for Zn(H2O)62+ and Zn(PPi)26-. Reprinted from Ref.[80]. 3D snapshot of (A) 0.2 M ZnBr2 system and (D) 0.2 M ZnCl2-K4PPi (1:3) system obtained from molecular dynamics (MD) simulations. RDFs for (B) ZnBr2 and (E) ZnCl2-K4PPi system collected from MD simulations. The optimized molecular structures and corresponding binding energies of (C) Zn(H2O)62+ and (F) Zn(PPi)26-.
