Transport and Structural Properties of Pure and Cr Doped Li3VO4

This study deals with the effects of 5 and 10% chromium additions on the transport and structural properties of Li3VO4. The Cr substitution is easily obtained without impurity phases and does not affect the room- and high-temperature host crystal structure, as evidenced by X-ray powder diffraction a...

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Veröffentlicht in:The journal of physical chemistry. B 2005-08, Vol.109 (31), p.14845-14851
Hauptverfasser: Massarotti, V, Capsoni, D, Bini, M, Mustarelli, P, Chiodelli, G, Azzoni, C. B, Galinetto, P, Mozzati, M. C
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container_end_page 14851
container_issue 31
container_start_page 14845
container_title The journal of physical chemistry. B
container_volume 109
creator Massarotti, V
Capsoni, D
Bini, M
Mustarelli, P
Chiodelli, G
Azzoni, C. B
Galinetto, P
Mozzati, M. C
description This study deals with the effects of 5 and 10% chromium additions on the transport and structural properties of Li3VO4. The Cr substitution is easily obtained without impurity phases and does not affect the room- and high-temperature host crystal structure, as evidenced by X-ray powder diffraction and micro-Raman analysis. The EPR signals are interpreted in terms of quantified amounts of Cr ions in 5+ and 3+ valence states. Suitable 7Li and 51V MAS NMR spectra simulations agree with the EPR results about the relative amount of Cr5+ and Cr3+ ions substituted in V5+ and Li+ sites, respectively. The Cr3+ presence on Li site, also suggested by Raman results and Rietveld refinements, requires Li vacancies to maintain the charge neutrality. The p-type conductivity, suggested by the positive thermoelectric power coefficients, significantly increases by the cation doping up to an order of magnitude.
doi_str_mv 10.1021/jp051166v
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