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Wu, D., et al. (2014). "Origin of the High Performance in GeTe-Based Thermoelectric Materials upon Bi2Te3 Doping." J Am Chem Soc 136(32): 11412-11419.
        As a lead-free material, GeTe has drawn growing attention in thermoelectrics, and a figure of merit (ZT) close to unity was previously obtained via traditional doping/alloying, largely through hole carrier concentration tuning. In this report, we show that a remarkably high ZT of approximately 1.9 can be achieved at 773 K in Ge0.87Pb0.13Te upon the introduction of 3 mol % Bi2Te3. Bismuth telluride promotes the solubility of PbTe in the GeTe matrix, thus leading to a significantly reduced thermal conductivity. At the same time, it enhances the thermopower by activating a much higher fraction of charge transport from the highly degenerate Sigma valence band, as evidenced by density functional theory calculations. These mechanisms are incorporated and discussed in a three-band (L + Sigma + C) model and are found to explain the experimental results well. Analysis of the detailed microstructure (including rhombohedral twin structures) in Ge0.87Pb0.13Te + 3 mol % Bi2Te3 was carried out using transmission electron microscopy and crystallographic group theory. The complex microstructure explains the reduced lattice thermal conductivity and electrical conductivity as well.
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[92] J.O. Sofo, G.D. Mahan, Appl. Phys. Lett. 65 (1994) 2690.
[93] D.A. Broido, T.L. Reinecke, Phys. Rev. B 51 (1995) 13797.
[94] T.C. Harman, D.L. Spears, M.J. Manfra, J. Electron. Mater. 25 (1996) 1121.
[95] L.D. Hicks, T.C. Harman, X. Sun, M.S. Dresselhaus, Phys. Rev. B 53 (1999) R10493.
[96] T.C. Harman, P.J. Taylor, D.L. Spears, M.P. Walsh, J. Electron. Mater. 29 (2000) L1.
[97] T.C. Harman, P.J. Taylor, M.P. Walsh, B.E. LaForge, Science 279 (2002) 2229.
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J.O. Sofo, G.D. Mahan, Appl. Phys. Lett. 65 (1994) 2690.
D.A. Broido, T.L. Reinecke, Phys. Rev. B 51 (1995) 13797.
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Thermoelectric Power Factor Enhancement Mechanisms and Strategies for Higher Performance Thermoelectric Materials
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Thermoelectric Power Factor Enhancement Mechanisms and Strategies for Higher Performance Thermoelectric Materials...

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