“…Therefore, competitive solvation potential (Δ P = Δ E SE − Δ E CE ) is applied to compare the adsorption energy and cohesion strength of Li 2 S x to evaluate the adsorption ability and stability. According to previous studies, 62–64 the value of Δ E CE increases with the number of cluster aggregates ((Li 2 S n ) x , n = 2, 4, 6, 8, and x = 1, 2, 6), and Δ E CE of ((Li 2 S n ) 6 , n = 2, 4, 6, 8) are 1.80398, 1.0063, 0.96771 and 1.0063, respectively. The negative Δ P indicates that the Li 2 S n molecule is facile to aggregate, resulting in a sluggish conversion reaction.…”