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Atomistic nucleation sites of Pt nanoparticles on N-doped carbon nanotubes

机译:原子论的Pt纳米粒子的成核的网站n型碳纳米管

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摘要

The atomistic nucleation sites of Pt nanoparticles (Pt NPs) on N-doped carbon nanotubes (N-CNTs) were investigated using C and N K-edge and Pt L3-edge X-ray absorption near-edge structure (XANES)/ extended X-ray absorption fine structure (EXAFS) spectroscopy. Transmission electron microscopy and XANES/EXAFS results revealed that the self-organized Pt NPs on N-CNTs are uniformly distributed because of the relatively high binding energies of the adsorbed Pt atoms at the imperfect sites. During the atomistic nucleation process of Pt NPs on N-CNTs, stable Pt-C and Pt-N bonds are presumably formed, and charge transfer occurs at the surface/interface of the N-CNTs. The findings in this study were consistent with density functional theory calculations performed using cluster models for the undoped, substitutional-N-doped and pyridine-like-N-doped CNTs.
机译:Pt纳米粒子的原子论的成核站点(Pt NPs) n型碳纳米管(N-CNTs)研究了使用C和N K-edge和Pt吗L3-edge x射线吸收靠近边缘结构(黄嘌呤)/扩展x射线吸收精细结构(EXAFS)光谱。显微镜和黄嘌呤/ EXAFS结果显示的自组织Pt NPs N-CNTs是一致的由于相对较高的分布吸附Pt原子的结合能不完美的网站。过程的Pt NPs N-CNTs稳定Pt-C Pt-N债券是可能形成和电荷转移发生在N-CNTs的表面/界面。这项研究的结果是一致的密度泛函理论计算执行无掺杂使用集群模型,substitutional-N-doped和pyridine-like-N-doped碳纳米管。

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