Thermoelectric and transport properties of sintered n-type K8Ba16Ga40Sn96 with type-II clathrate structure

作者: Shota Koda , Kengo Kishimoto , Koji Akai , Hironori Asada , Tsuyoshi Koyanagi

DOI: 10.1063/1.4889822

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摘要: This clathrate had a maximum dimensionless figure-of-merit, ZT, of 0.93 at 637 K, which was slightly higher than that 0.83 for the sintered type-VIII Ba8Ga16Sn30. We investigated high-temperature thermoelectric properties, transport electronic structures, and thermal stabilities clathrates. The type-II found to be superior as material; it high stability melting point, 859 K, mobility, 141 cm2V−1s−1 300 K, because its low inertial mass, lattice conductivity, approximately 4 mW cm−1K−1, resulting from larger unit cell weaker bipolar conduction. discuss these properties in terms structure differences between two types clathrate.

参考文章(29)
V. L. Kuznetsov, L. A. Kuznetsova, A. E. Kaliazin, D. M. Rowe, Preparation and thermoelectric properties of A8IIB16IIIB30IV clathrate compounds Journal of Applied Physics. ,vol. 87, pp. 7871- 7875 ,(2000) , 10.1063/1.373469
George S. Nolas, Glen A. Slack, Sandra B. Schujman, Chapter 6 Semiconductor clathrates: A phonon glass electron crystal material with potential for thermoelectric applications Semiconductors and Semimetals. ,vol. 69, pp. 255- 300 ,(2001) , 10.1016/S0080-8784(01)80152-6
Yasushi Kono, Nobuyuki Ohya, Takashi Taguchi, Koichiro Suekuni, Toshiro Takabatake, Setsuo Yamamoto, Koji Akai, First-principles study of type-I and type-VIII Ba8Ga16Sn30 clathrates Journal of Applied Physics. ,vol. 107, pp. 123720- ,(2010) , 10.1063/1.3437252
G. S. Nolas, J. L. Cohn, G. A. Slack, S. B. Schujman, Semiconducting Ge clathrates: Promising candidates for thermoelectric applications Applied Physics Letters. ,vol. 73, pp. 178- 180 ,(1998) , 10.1063/1.121747
John P. Perdew, Kieron Burke, Matthias Ernzerhof, Generalized Gradient Approximation Made Simple Physical Review Letters. ,vol. 77, pp. 3865- 3868 ,(1996) , 10.1103/PHYSREVLETT.77.3865
Payam Norouzzadeh, Charles W. Myles, Daryoosh Vashaee, Electronic, elastic, vibrational, and thermodynamic properties of type-VIII clathrates Ba8Ga16Sn30 and Ba8Al16Sn30 by first principles Journal of Applied Physics. ,vol. 114, pp. 163509- ,(2013) , 10.1063/1.4826213
S. Mano, T. Onimaru, S. Yamanaka, T. Takabatake, Off-center rattling and thermoelectric properties of type-II clathrate (K, Ba) 24 (Ga, Sn, □) 136 single crystals Physical Review B. ,vol. 84, pp. 214101- ,(2011) , 10.1103/PHYSREVB.84.214101
Rolf E. Lindquist, A. W. Ewald, Optical Constants of Single-Crystal Gray Tin in the Infrared Physical Review. ,vol. 135, pp. 191- 194 ,(1964) , 10.1103/PHYSREV.135.A191
Y. Saiga, K. Suekuni, S.K. Deng, T. Yamamoto, Y. Kono, N. Ohya, T. Takabatake, Optimization of thermoelectric properties of type-VIII clathrate Ba8Ga16Sn30 by carrier tuning Journal of Alloys and Compounds. ,vol. 507, pp. 1- 5 ,(2010) , 10.1016/J.JALLCOM.2010.07.121