Sulfur K-Edge X-Ray-Absorption Study of the Charge Transfer upon Lithium Intercalation into Titanium Disulfide

Z. Y. Wu, G. Ouvrard, S. Lemaux, P. Moreau, P. Gressier, F. Lemoigno, and J. Rouxel
Phys. Rev. Lett. 77, 2101 – Published 2 September 1996
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Abstract

Sulfur K-edge x-ray-absorption spectra have been recorded for lithium intercalated titanium disulfides LixTiS2. The near-edge features up to 30 eV above threshold are interpreted in the framework of full multiple-scattering theory. We show that the electrons transferred from intercalated lithium atoms are not only located on Ti 3d orbitals, as previously assumed, but also on the S 3p states. For comparison, we present the S p-projected density of states derived from linear muffin-tin-orbital band structure calculations. An overall agreement between measurement and theory is very well achieved.

  • Received 16 May 1996

DOI:https://doi.org/10.1103/PhysRevLett.77.2101

©1996 American Physical Society

Authors & Affiliations

Z. Y. Wu, G. Ouvrard, S. Lemaux, P. Moreau, P. Gressier, F. Lemoigno, and J. Rouxel

  • Institut des Matériaux de Nantes, Centre National de la Recherche Scientifique UMR 110, Laboratoire de Chimie des Solides, 2 rue de la Houssinière, 44072 Nantes Cedex 03, France

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Vol. 77, Iss. 10 — 2 September 1996

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