Functionalization-Driven Charge Redistribution Enabling Ultra-High-Capacity V2B MBene Anode for Li/Na ion batteries: A First-Principles study
Amid increasing global demand for clean, sustainable energy, the search for novel electrode materials has emerged as a crucial link to advancing future energy storage technologies. Here, we explored the potential of N-functionalized 2D MBene V2BN2 as anode materials for Li- and Na-ion batteries using first-principles c...