발간논문

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Vol.61, No.3, 198 ~ 206, 2023
Title
The Mechanism behind the High Thermoelectric Performance in YbCd2-xMgxSb2
권승환 Seung-hwan Kwon , 김상일 Sang-il Kim , 허민수 Minsu Heo , 서원선 Won-seon Seo , 노종욱 Jong Wook Roh , 양희선 Heesun Yang , 김현식 Hyun-sik Kim
Abstract
YbCd2Sb2 is a promising Zintl compound for waste heat recovery applications due to its low thermal conductivity, originating from its complex crystal structure. Many strategies such as alloying or doping have been suggested to further reduce the thermal conductivity of YbCd2Sb2 to improve its thermoelectric performance. However, the effects of alloying or doping on the electronic transport properties of YbCd2Sb2 have not been evaluated in detail. Here, previously reported thermoelectric properties of YbCd2-xMgxSb2 (x = 0, 0.2, 0.4) with drastic thermal conductivity suppression were evaluated using the Single Parabolic Band (SPB) model and Callaway von Bayer (CvB) model. The SPB and CvB models evaluate any changes in electronic band parameters and phonon scattering strength, respectively, due to Mg alloying. Based on the SPB model, Mg alloying deteriorated the weighted mobility, mostly due to non-degenerate mobility reduction. However, the magnitude of point-defect phonon scattering significantly increased with Mg alloying, as evaluated by the CvB model. As a result, the maximum zT is achieved when x = 0.4 at 700 K despite the decreased electronic transport properties from Mg alloying. Our work suggests that carefully designed alloying can improve the thermoelectric performance of the Zintl compound even when it changes its electronic and thermal transport properties in opposite directions. (Received 21 November, 2022; Accepted 6 December, 2022)
Key Words
zintl phase, YbCd2Sb2, single parabolic band model, callaway von bayer model
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