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Modulating p-d orbital hybridization by CuO/Cu nanoparticles enables carbon nanofibers high cycling stability as anode for sodium storage
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作者 Zhi-Jia Zhang He-Yi Sun +7 位作者 Yue-Fang Chen Yu-Wen Zhao Meng-Meng Zhang Chun-Sheng Li Yan Sun zhong-hui gao Hui-Jun Li Yong Jiang 《Rare Metals》 SCIE EI CAS CSCD 2023年第12期4039-4047,共9页
Carbon nanofibers(CNFs)have been extensively studied as anode materials for sodium-ion batteries due to their high conductivity,large aspect ratio and good electrochemical stability.The low specific capacity and low f... Carbon nanofibers(CNFs)have been extensively studied as anode materials for sodium-ion batteries due to their high conductivity,large aspect ratio and good electrochemical stability.The low specific capacity and low first cycle efficiency of CNFs,however,have hindered its practical application.Herein,we present a facile strategy to synthesize a novel CNFs decorated with Cu/CuO nanoparticles(Cu-CNFs)using magnetron sputtering method.Cu/CuO nanoparticles were uniformly distributed on the surface of CNFs.According to the density functional theory(DFT)calculation,Cu/CuO nanoparticles d-orbitals and CNFs p-orbitals present hybridization states,and the Na~+adsorption energy of the modified CNFs decreases from-2.14 to-2.97 eV.The Cu-CNFs composites exhibit excellent sodium storage properties,presenting a desirable initial Coulombic efficiency of 76%and a high specific reversible capacity of 300 mAh·g^(-1)at 0.1 A·g^(-1)after 400 cycles.Cu-CNFs anode has excellent cycling stability under high current density,maintaining a high capacity of 150 mAh·g^(-1)at 1 A·g^(-1)after 6000 cycles.Using magnetron sputtering to regulate the electronic structure provides a new thought for improving the electrochemical performance of carbon materials. 展开更多
关键词 Carbon nanofibers Cu/CuO nanoparticles Orbital hybridization Magnetron sputtering Density functional theory calculation
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