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Two‐Dimensional Layered Metallic VSe<sub>2</sub>/SWCNTs/rGO Based Ternary Hybrid Materials for High Performance Energy Storage Applications

K. A. Sree Raj, Afsal S. Shajahan, Brahmananda Chakraborty, Chandra Sekhar Rout

2020Chemistry - A European Journal62 citationsDOI

Abstract

Abstract In this work, the ternary hybrid structure VSe 2 /SWCNTs/rGO is reported for supercapacitor applications. The ternary composite exhibits a high specific capacitance of 450 F g −1 in a symmetric cell configuration, with maximum energy density of 131.4 Wh kg −1 and power density of 27.49 kW kg −1 . The ternary hybrid also shows a cyclic stability of 91 % after 5000 cycles. Extensive density functional theory (DFT) simulations on the structure as well as on the electronic properties of the binary hybrid structure VSe 2 /SWCNTs and the ternary hybrid structure VSe 2 /SWCNTs/rGO have been carried out. Due to a synergic effect, there are enhanced density of states near the Fermi level and higher quantum capacitance for the hybrid ternary structure compared to VSe 2 /SWCNTs, leading to higher energy and power density for VSe 2 /SWCNTs/rGO, supporting our experimental observation. Computed diffusion energy barrier of electrolyte ions (K + ) predicts that ions move faster in the ternary structure, providing higher charge storage performance.

Topics & Concepts

Ternary operationMaterials scienceSupercapacitorDensity functional theoryQuantum capacitanceCapacitanceElectrolytePower densityFermi levelNanotechnologyChemical physicsPhysical chemistryElectronChemistryComputational chemistryThermodynamicsElectrodePower (physics)PhysicsComputer scienceQuantum mechanicsProgramming languageMXene and MAX Phase MaterialsSupercapacitor Materials and FabricationAdvancements in Battery Materials
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