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首页> 外文期刊>Journal of Materials Research >Ni/C nanostructures: Impregnating-method preparation, textural and structural features, and catalytic property for the hydrogen production
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Ni/C nanostructures: Impregnating-method preparation, textural and structural features, and catalytic property for the hydrogen production

机译:Ni / C纳米结构:浸渍法制备,结构和结构特征以及制氢的催化性能

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摘要

A series of Ni/C catalysts with different Ni content (15, 20, and 30 wt% Ni) were prepared by the wet incipient impregnation method. Their textural properties were studied by surface fractal dimension (D_s) and nonlocal density functional theory using nitrogen sorption data. Their structural properties were studied by x-ray diffraction, Rietveld refinement, radial distribution functions (RDFs), and electron density maps of Fourier. Surface areas of Ni/C catalysts decreases slightly from 614 to 533 m~2/g as Ni content increases from 15 to 30 wt%; however, the Ni crystallite size (5.1-31.4 nm) increases as the nickel content increases. Many point defects were found by Rietveld refinement in nickel nanostructures of Ni/C catalysts with 20 and 30 wt% Ni. This was confirmed by RDFs and electronic density maps. On the other hand, the hydrogen production via the photodehydrogenation of ethanol is very sensitive to the nickel crystallite size and the number Ni atoms in nickel nanostructures. The maximum reaction rate (363.64 μmol/h) is achieved on Ni/C catalyst with 15 Wt% Ni content which has the smallest crystallite size (5.1 nm) and less point defects in its nickel nanostructures. Ab initio calculations were performed to propose a reaction mechanism in the photodehydrogenation of ethanol.
机译:通过湿法初始浸渍法制备了一系列具有不同Ni含量(15、20和30 wt%Ni)的Ni / C催化剂。通过表面分形维数(D_s)和非局部密度泛函理论,利用氮吸附数据研究了它们的组织结构。通过X射线衍射,Rietveld精细化,径向分布函数(RDFs)和傅立叶电子密度图研究了它们的结构性质。随着Ni含量从15wt%增加到30wt%,Ni / C催化剂的表面积从614降低到533m 2 / g。然而,随着镍含量的增加,镍微晶尺寸(5.1-31.4 nm)也随之增加。通过Rietveld精炼发现,Ni / C催化剂中含20%和30%(重量)的Ni的镍纳米结构存在许多点缺陷。 RDF和电子密度图证实了这一点。另一方面,通过乙醇的光脱氢产生的氢对镍微晶尺寸和镍纳米结构中的镍原子数非常敏感。在Ni / C含量为15 Wt%的Ni / C催化剂上可实现最大反应速率(363.64μmol/ h),该催化剂具有最小的微晶尺寸(5.1 nm)和镍纳米结构中的点缺陷少。进行了从头算以提出乙醇光脱氢的反应机理。

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  • 来源
    《Journal of Materials Research 》 |2013年第23期| 3297-3309| 共13页
  • 作者单位

    Universidad National Autonoma de Mexico (U.N.A.M.), 01000 Mexico City, Mexico, ESIQIE, Institute Politecnico National, 07738 Mexico D. F., Mexico, and Department of Chemistry, Universidad Autonoma Metropolitana-Iztapalapa, Mexico City, D.F. 09340, Mexico;

    ESIQIE, Instituto Politecnico National, 07738 Mexico D. F., Mexico;

    ESIQIE, Instituto Politecnico National, 07738 Mexico D. F., Mexico;

    Universidad National Autonoma de Mexico (U.N.A.M.), 01000 Mexico City, Mexico;

    Department of Chemistry, Universidad Autonoma Metropolitana-Iztapalapa, Mexico City, D.F. 09340, Mexico;

    Department of Chemistry, Universidad Autonoma Metropolitana-Iztapalapa, Mexico City, D.F. 09340, Mexico;

  • 收录信息 美国《科学引文索引》(SCI);美国《工程索引》(EI);美国《生物学医学文摘》(MEDLINE);
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  • 正文语种 eng
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