In this study, we investigate the effects of tantalum (Ta) doping on the performance and stability of LiNi0.80Mn0.1Co0.1O2 (NMC811) cathode materials. Using a combined theoretical and experimental approach, we employ density functional theory (DFT) and cluster expansion models to analyze the ...
The aim of most of the performed research works on Lithium-ion batteries (LIBs) has focused on designing and fabricating high-capacity cathode materials, finding shorter paths of Li-ion migration, and providing high kinetics and high surface area. Among the fabricated cathode materials, olivine-...