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Discovery of multivalley Fermi surface responsible for the high thermoelectric performance in Yb14MnSb11 and Yb14MgSb11.


ABSTRACT: The Zintl phases, Yb14MSb11 (M = Mn, Mg, Al, Zn), are now some of the highest thermoelectric efficiency p-type materials with stability above 873 K. Yb14MnSb11 gained prominence as the first p-type thermoelectric material to double the efficiency of SiGe alloy, the heritage material in radioisotope thermoelectric generators used to power NASA's deep space exploration. This study investigates the solid solution of Yb14Mg1-x Al x Sb11 (0 ≤ x ≤ 1), which enables a full mapping of the metal-to-semiconductor transition. Using a combined theoretical and experimental approach, we show that a second, high valley degeneracy (Nv = 8) band is responsible for the groundbreaking performance of Yb14MSb11 This multiband understanding of the properties provides insight into other thermoelectric systems (La3-x Te4, SnTe, Ag9AlSe6, and Eu9CdSb9), and the model predicts that an increase in carrier concentration can lead to zT > 1.5 in Yb14MSb11 systems.

SUBMITTER: Perez CJ 

PROVIDER: S-EPMC7817104 | biostudies-literature | 2021 Jan

REPOSITORIES: biostudies-literature

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Discovery of multivalley Fermi surface responsible for the high thermoelectric performance in Yb<sub>14</sub>MnSb<sub>11</sub> and Yb<sub>14</sub>MgSb<sub>11</sub>.

Perez Christopher J CJ   Wood Maxwell M   Ricci Francesco F   Yu Guodong G   Vo Trinh T   Bux Sabah K SK   Hautier Geoffroy G   Rignanese Gian-Marco GM   Snyder G Jeffrey GJ   Kauzlarich Susan M SM  

Science advances 20210120 4


The Zintl phases, Yb<sub>14</sub> <i>M</i>Sb<sub>11</sub> (<i>M</i> = Mn, Mg, Al, Zn), are now some of the highest thermoelectric efficiency p-type materials with stability above 873 K. Yb<sub>14</sub>MnSb<sub>11</sub> gained prominence as the first p-type thermoelectric material to double the efficiency of SiGe alloy, the heritage material in radioisotope thermoelectric generators used to power NASA's deep space exploration. This study investigates the solid solution of Yb<sub>14</sub>Mg<sub>1-  ...[more]

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