Functionalization-driven modulation of electronic structure and quantum capacitance in o-MXene Y2VC2Tx (Tx = O2, F2, and OF) for high-performance energy storage

Abstract In this study, first-principles calculations based on density functional theory (DFT) combined with the pseudopotential method are employed to investigate and compare the electronic properties, structural stability, and energy-storage potential of novel two-dimensional binary transition met...

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Principais autores:	Navid Mokhtaripoor, Peiman Amiri, Amir Aliakbari
Formato:	Artigo
Idioma:	Inglês
Publicado:	Nature Portfolio 2026-05-01
Series:	Scientific Reports
Assuntos:	Y2VC2Tx (Tx = O2, F2, and OF) o-MXene Electronic properties Quantum capacitance Supercapacitor Density functional theory
Acceso en liña:	https://doi.org/10.1038/s41598-026-50780-z
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