过电位
材料科学
密度泛函理论
X射线吸收精细结构
催化作用
电子结构
碳纳米管
铂金
电子转移
化学工程
化学物理
纳米技术
物理化学
计算化学
电化学
化学
有机化学
电极
工程类
物理
量子力学
光谱学
作者
Yidan Peng,Kui Ma,Tianzhu Xie,Jiaqi Du,Lirong Zheng,Fengbao Zhang,Xiaobin Fan,Wenchao Peng,Junyi Ji,Yang Li
标识
DOI:10.1021/acsami.3c04028
摘要
Developing cost-effective Pt-based electrocatalysts for the hydrogen evolution reaction (HER) is highly urgent. Herein, we report novel electrocatalysts with individually dispersed Pt active sites and tunable Pt-Ni interaction decorated on carbon-wrapped nanotube frameworks (Pt/Ni-DA). Pt/Ni-DA exhibits superior HER performance at low Pt concentrations with an ultralow overpotential of 18 mV at 10 mA cm-2 and an ultrahigh mass activity of 2.13 A mgPt-1 at an overpotential of 50 mV, which is about four times higher than that of commercial Pt/C. X-ray absorption fine structure (XAFS) confirms the extension of Pt from the Ni surface to the Ni bulk phase. Mechanistic research and density functional theory (DFT) calculations collectively reveal that the dispersibility and distribution of Pt atoms in Ni regulate the electronic configuration of Pt sites, optimizing the binding energy of reaction intermediates and facilitating electron transfer during the HER process. This work highlights the importance of the electronic structure alternation through the accommodation effect toward enhanced catalytic performance in HER.
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