Ab initio study of adsorption and diffusion of lithium on transition metal dichalcogenide monolayers

• Xiaoli Sun and
• Zhiguo Wang

Beilstein J. Nanotechnol. 2017, 8, 2711–2718, doi:10.3762/bjnano.8.270

• monolayers explored in this work can be used as promising anode materials for lithium ion batteries. Keywords: anode materials; lithium adsorption; lithium diffusion; lithium ion batteries; transition metal dichalcogenide; Introduction Lithium ion batteries (LIBs) have been widely used in portable