Procedure of Cell-Impedance-Controlled Current Transients with Kinetic Monte Carlo Method

1 Calculation Procedure of Cell-Impedance-Controlled Current Transients with Kinetic Monte Carlo Method 

Recently, Pyun et al. applied a kinetic Monte Carlo (KMC) method to explore the effect of phase transition due to strong interaction between lithium ions in transition metal oxides with the cubic-spinel structure on lithium transport [17, 28, 103]. The group used the same model for the cubic-spinel structure as described in Section 5.2.3, based on the lattice gas theory. For KMC simulation in a canonical ensemble (CE) where all the microstates have equal V, T, and N, the transition state theory is employed in conjunction with spin-exchange dynamics [104, 105]. 

The flux oflithium ions at tlie electrolyte/electrode interface, which corresponds to 

---