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首页> 外文期刊>Physical review letters >Is there a Difference in Van Der Waals Interactions between Rare Gas Atoms Adsorbed on Metallic and Semiconducting Single-Walled Carbon Nanotubes?
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Is there a Difference in Van Der Waals Interactions between Rare Gas Atoms Adsorbed on Metallic and Semiconducting Single-Walled Carbon Nanotubes?

机译:金属和半导体单壁碳纳米管上吸附的稀有气体原子之间的范德华相互作用是否有所不同?

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摘要

The differences in the polarizabilities of metallic (M) and semiconducting (S) single-walled carbon nanotubes (SWNTs) might give rise to differences in adsorption potentials. We show from experiments and van der Waals-corrected density functional theory that the binding energies of Xe adsorbed on M- and S-SWNTs are nearly identical. Temperature programed desorption experiments of Xe on purified M- and S-SWNTs give similar peak temperatures, indicating that desorption kinetics and binding energies are independent of the type of SWNT. Binding energies computed from vdW-corrected density functional theory are in good agreement with experiments.
机译:金属(M)和半导体(S)单壁碳纳米管(SWNT)极化率的差异可能会导致吸附电位的差异。我们通过实验和范德华校正的密度泛函理论表明,Xe吸附在M-SWNT和S-SWNTs上的结合能几乎相同。 Xe在纯化的M-SWNT和S-SWNT上的程序升温脱附实验给出了相似的峰值温度,表明脱附动力学和结合能与SWNT的类型无关。根据vdW校正的密度泛函理论计算的结合能与实验非常吻合。

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  • 来源
    《Physical review letters》 |2013年第13期|135503.1-135503.5|共5页
  • 作者单位

    Department of Chemical and Petroleum Engineering, University of Pittsburgh, Pittsburgh, Pennsylvania 15261, USA;

    Department of Chemistry, University of Virginia, Virginia 22904, USA;

    Department of Chemical and Petroleum Engineering, University of Pittsburgh, Pittsburgh, Pennsylvania 15261, USA;

    Department of Chemistry, University of Virginia, Virginia 22904, USA;

    Department of Physics, Penn State University, University Park, Pennsylvania 16802, USA;

    Department of Chemical and Petroleum Engineering, University of Pittsburgh, Pittsburgh, Pennsylvania 15261, USA;

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  • 原文格式 PDF
  • 正文语种 eng
  • 中图分类
  • 关键词

    thermal desorption;

    机译:热脱附;

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