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Phys. Rev. B 58, 7668–7674 (1998)

Polarized x-ray-absorption spectra of TiS2, TiSe2, and TiTe2

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S. Bocharov, G. Dräger, and D. Heumann
Fachbereich Physik der Martin-Luther-Universität Halle-Wittenberg, Friedemann-Bach-Platz 6, D-06108 Halle, Germany

A. Šimůnek and O. Šipr
Institute of Physics, Academy of Sciences of the Czech Republic, Cukrovarnická 10, 16200 Praha 6, Czech Republic

Received 23 March 1998; revised 18 May 1998; published in the issue dated 15 September 1998

We studied the anisotropy of the unoccupied electron states of three titanium dichalcogenides by means of polarized x-ray-absorption spectroscopy. The experimental spectra of TiS2, TiSe2, and TiTe2 at the Ti K edge and of TiTe2 at the Te L1 edge were compared with the results of real-space multiple-scattering calculations. The local angular momentum projections of the densities of states at the titanium sites are presented for energies up to 25 eV above the Fermi level. The Ti K-edge spectra of all three dichalcogenides are quite similar to each other provided the differences in their lattice constants are suppressed by comparing the spectra in equivalent energy scales. However, the correspondence between the Te L1 edge of TiTe2 and the S K edge of TiS2 is much less pronounced. For most of the spectra good agreement between experiment and theory was found.

© 1998 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevB.58.7668
DOI:
10.1103/PhysRevB.58.7668
PACS:
78.70.Dm, 71.15.Cr, 71.20.-b