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Features of Extended XPS Spectra of C2FBr0.15 Intercalate and Silver Foil

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Abstract

The possibility to obtain novel data by standard electron spectroscopy and quantum chemical techniques is exemplified by C2FBr0.15 intercalate and silver foil. The features of extended X-ray photoelectron spectra are interpreted by electronic transitions in the valence band of similar unit cells. The analysis of experimental and calculated spectra reveals two states of intercalated Br2: molecular and chain-like. The interaction of Ag with NO2 at 300–520 K is limited by the formation of an oxidized state in the near-surface layer with a thickness of ∼6 A, with the metallic state of silver dominating in the Ag3d И Ag MNN spectra. Geometric parameters, states of atoms, and the character of bonds between them are consistent with the previously obtained results.

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Funding

The work was supported by RFBR (grant 17-03-00049), budget project AAAA-A17-117041710078-1 for the Boreskov Institute of Catalysis, Siberian Branch, Russian Academy of Sciences and used the facilities of the Supercomputer Center, Institute of Computational Mathematics and Mathematical Geophysics, Siberian Branch, Russian Academy of Sciences.

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Authors and Affiliations

  1. Boreskov Institute of Catalysis, Siberian Branch, Russian Academy of Sciences, Novosibirsk, Russia

    A. R. Cholach, A. A. Bryliakova, A. V. Kalinkin & M. Yu. Smirnov

  2. Nikolaev Institute of Inorganic Chemistry, Siberian Branch, Russian Academy of Sciences, Novosibirsk, Russia

    I. P. Asanov

  3. Novosibirsk State University, Novosibirsk, Russia

    I. P. Asanov

Authors
  1. A. R. Cholach
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  2. I. P. Asanov
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  3. A. A. Bryliakova
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  4. A. V. Kalinkin
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  5. M. Yu. Smirnov
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Correspondence to A. R. Cholach.

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Russian Text © The Author(s), 2020, published in Zhurnal Strukturnoi Khimii, 2020, Vol. 61, No. 4, pp. 553–562.

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Cholach, A.R., Asanov, I.P., Bryliakova, A.A. et al. Features of Extended XPS Spectra of C2FBr0.15 Intercalate and Silver Foil. J Struct Chem 61, 523–532 (2020). https://doi.org/10.1134/S0022476620040046

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  • DOI: https://doi.org/10.1134/S0022476620040046

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