Elsevier

Chemical Physics Letters

Volume 9, Issue 2, 15 April 1971, Pages 160-162
Chemical Physics Letters

Use of the Mössbauer isomer shift and the X-ray emission Kα shift to estimate the effective electronic population of iron in complexes

https://doi.org/10.1016/0009-2614(71)80213-0Get rights and content

Abstract

The Hartree-Fock method is used to calculate the Kα transition energy for a number of configurations of different Fe ions. Experimental X-ray emission Kα shifts are combined with Mössbauer isomer shifts to estimate the effective configurations of the iron ion.

References (5)

  • R.L. Barinski et al.
    (1969)
  • G. Leonhardt et al.

    J. Chem. Phys.

    (1970)
There are more references available in the full text version of this article.

Cited by (10)

  • Chemical effects correlated to nitrogen content of iron nitride films observed in the Fe L-shell X-rays induced by 5-keV electrons

    2014, Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms
    Citation Excerpt :

    The L-shell X-rays are affected as well, but have been less analyzed [16–19], as well as the satellite lines [20,21], and the absorption edges [22]. Many efforts have been made to distinguish the oxidation state of iron in minerals using the chemical effect [23], or the X-ray absorption near edge structure (XANES) [24], but only a few studies were related to other ligands of the iron atom than oxygen [3,4,9,13,15]. The electronic shells of free iron atoms are filled until [Ar] 3d5+1− 4s1+1− [25], while ideally Fe3+ corresponds to [Ar] 3d5+ and Fe2+ to [Ar] 3d5+1−.

  • Electronic structure and spectra of [Fe(CN)<inf>6</inf>SO<inf>3</inf>]<sup>4-</sup>

    1992, Spectrochimica Acta Part A: Molecular Spectroscopy
  • Mössbauer isomer shifts and the multiple-scattering method

    1975, Journal of Physics and Chemistry of Solids
View all citing articles on Scopus
View full text