Atomistic mechanisms underlying the maximum in diffusivity in doped Li${}_7$La${}_3$Zr${}_2$O${}_{12}$

Juan C. Verduzco, Ernesto E. Marinero, Alejandro Strachan

Doped lithium lanthanum zirconium oxide (LLZO) is a promising class of solid electrolytes for lithium-ion batteries due to their good electrochemical stability and compatibility wi…