Extended x-ray absorption fine-structure determinations of coordination numbers: Limitations

P. Eisenberger and B. Lengeler
Phys. Rev. B 22, 3551 – Published 15 October 1980
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Abstract

Comparisons are made between measured extended x-ray absorption fine-structure (EXAFS) amplitudes for nearest- and more-distant-neighbor coordination shells in a wide variety of known compounds at both room temperature and 77 K. The comparisons reveal a significant sensitivity of the amplitudes to the chemical environment and non-Gaussian disorder. The observed changes can cause significant errors in the empirical determinations of coordination numbers. The absence of the possibility of a quantitative theoretical calculation of the EXAFS amplitude leads to the conclusion that coordination numbers can be determined most accurately by the use of a chemically and structurally similar model measured at low temperature.

  • Received 7 February 1980

DOI:https://doi.org/10.1103/PhysRevB.22.3551

©1980 American Physical Society

Authors & Affiliations

P. Eisenberger

  • Bell Laboratories, Murray Hill, New Jersey 07974

B. Lengeler

  • Institut für Festkorperforschung, Kernforschungsanlage Jülich, 5170 Jülich, Federal Republic of Germany

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Vol. 22, Iss. 8 — 15 October 1980

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