Classification of Fe-bearing species from K-edge XANES data using two-parameter correlation plots

J Synchrotron Radiat. 2008 Sep;15(Pt 5):463-8. doi: 10.1107/S0909049508018293. Epub 2008 Aug 19.

Abstract

Solid iron compounds are extremely common in the environment as well as in meteorites and comets. Fe K-edge XANES (X-ray absorption near-edge structure) measurements can be carried out quickly, theoretically allowing one to categorize many areas within a sample or set of samples in a short time. However, interpretation of such data is not straightforward unless one has the appropriate reference spectra, hence a way of classifying an unknown spectrum to a family group (trivalent, divalent, oxide, silicate etc.) is required. Methods of abstracting Fe XANES spectra to produce pairs of variables which, when plotted, cluster in distinct regions depending on the family are presented. For instance, divalent minerals fall in a different region than trivalent minerals, and sulfides in a different region than oxides.

Publication types

  • Research Support, U.S. Gov't, Non-P.H.S.

MeSH terms

  • Iron Compounds / chemistry*
  • Spectrum Analysis
  • X-Rays

Substances

  • Iron Compounds