New Chemical Insights into the Beneficial Role of AlO Cathode Coatings in Lithium-ion Cells.

Inorganic surface coatings such as AlO are commonly applied on positive electrode materials to improve the cycling stability and lifetime of lithium-ion cells. The beneficial effects are typically attributed to the chemical scavenging of corrosive HF and the physical blockage of electrolyte components from reaching the electrode surface. The present work combines published thermochemistry data with new density functional theory calculations to propose a new mechanism of action: the spontaneous reaction of the LiPF electrolyte salt with AlO-based surface coatings.