In our recent publication, we used an iodide model from Fyta and Netz1 for molecular dynamics simulations. Since two different iodide models were reported in their paper, we here explicitly state the ionic force field parameters used in our study. Our simulations were performed using the iodide force field model corresponding to the iodide ion model I(4) in the Fyta and Netz paper.1 The ion−ion and ion−water parameters are reported in Table 1 for iodide, together with the (Table Presented).
All Science Journal Classification (ASJC) codes
- General Chemistry
- Colloid and Surface Chemistry