First-principles calculations of K-edge X-ray absorption near edge spectra of some transition metal dimers |
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Authors: | B. Wästberg A. Rosén D. E. Ellis |
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Affiliation: | 1. Department of Physics, Chalmers University of Technology and, University of G?teborg, S-412 96, G?teborg, Sweden 2. Department of Physics and Astronomy and Materials Research Center, Northwestern University, 60201, Evanston, IL, USA
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Abstract: | Theoretical X-ray absorption near-edge spectra have been evaluated for different bond lengths of Mn2, Co2 and Ni2 using a modified Xα scattered-wave procedure. |
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