Shuyi Lin

Jan 10, 2024 | link.aps.org | Shuyi Lin |Jiangsu Normal |Meiling Xu

Topological quantum materials have significant potential for application as anode materials due to their intrinsically high electronic conductivity against perturbation from defects or impurities. In this work, we utilize a combination of a swarm-intelligence structure search method and first-principles calculations to predict the global minimum of a BeN monolayer, suggesting it as a promising nodal-line semimetal anode for Li-ion batteries.

Dec 22, 2023 | pubs.rsc.org | Shuyi Lin |Jingyan Chen |Bi Zhang |Jian Hao

Lanthanium Nitride LaN9 Featuring Azide Units: the First Metal Nine-nitride as High-energy Density Material The high-pressure phase diagrams of the La-N binary system were systematically constructed using the CALYPSO method and first-principles calculations.

Aug 24, 2023 | link.aps.org | Feilong Wang |Jiangsu Normal |Meiling Xu |Shuyi Lin

Popular Summary A thermodynamically stable Be2C5 monolayer has been proposed as a potential Dirac anode material for potassium-ion batteries using a combination of structure prediction methods and first-principles calculations. The Be2C5 anode showcases a high energy density, which can be attributed to its high specific capacity and low average open-circuit voltage.