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带隙双层石墨烯的热电性质

Thermoelectric properties of gapped bilayer graphene.

作者信息

Suszalski Dominik, Rut Grzegorz, Rycerz Adam

机构信息

Marian Smoluchowski Institute of Physics, Jagiellonian University, Łojasiewicza 11, PL-30348 Kraków, Poland.

出版信息

J Phys Condens Matter. 2019 Oct 16;31(41):415501. doi: 10.1088/1361-648X/ab2d0c. Epub 2019 Jun 26.

DOI:10.1088/1361-648X/ab2d0c
PMID:31242476
Abstract

Unlike in conventional semiconductors, both the chemical potential and the band gap in bilayer graphene (BLG) can be tuned via application of external electric field. Among numerous device implications, this property also designates BLG as a candidate for high-performance thermoelectric material. In this theoretical study we have calculated the Seebeck coefficients for abrupt interface separating weakly- and heavily-doped areas in BLG, and for a more realistic rectangular sample of mesoscopic size, contacted by two electrodes. For a given band gap ([Formula: see text]) and temperature (T) the maximal Seebeck coefficient is close to the Goldsmid-Sharp value [Formula: see text], the deviations can be approximated by the asymptotic expression [Formula: see text], with the electron charge  -e, the Boltzmann constant [Formula: see text], and [Formula: see text]. Surprisingly, the effects of trigonal warping term in the BLG low-energy Hamiltonian are clearly visible at few-Kelvin temperatures, for all accessible values of [Formula: see text] meV. We also show that thermoelectric figure of merit is noticeably enhanced (ZT  >  3) when a rigid substrate suppresses out-of-plane vibrations, reducing the contribution from ZA phonons to the thermal conductivity.

摘要

与传统半导体不同,双层石墨烯(BLG)中的化学势和带隙都可以通过施加外部电场来调节。在众多器件应用中,这一特性也使双层石墨烯成为高性能热电材料的候选者。在这项理论研究中,我们计算了双层石墨烯中弱掺杂区和重掺杂区之间突变界面以及一个更实际的介观尺寸矩形样品(与两个电极接触)的塞贝克系数。对于给定的带隙([公式:见原文])和温度(T),最大塞贝克系数接近戈德史密斯 - 夏普值[公式:见原文],偏差可以用渐近表达式[公式:见原文]近似,其中电子电荷为 -e,玻尔兹曼常数[公式:见原文],以及[公式:见原文]。令人惊讶的是,对于所有可达的[公式:见原文]毫电子伏特值,在几开尔文温度下,双层石墨烯低能哈密顿量中的三角翘曲项的影响都清晰可见。我们还表明,当刚性衬底抑制面外振动,减少ZA声子对热导率的贡献时,热电优值会显著提高(ZT > 3)。

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