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Ultralow Lattice Thermal Conductivity in Ba23M10Ge10Sb25-δ (M = Ga, In): Quaternary Compounds Containing Ba-Centered Dodecahedra
Chemistry of Materials ( IF 8.6 ) Pub Date : 2018-06-22 00:00:00 , DOI: 10.1021/acs.chemmater.8b01441
Ming-Yan Pan 1, 2 , Hong-Ji Qi 1 , Xiao-Cun Liu 3 , Ming-Cheng Bai 1, 4 , Sheng-Qing Xia 2
Affiliation  

Two new quaternary compounds, Ba23Ga10Ge10Sb25 and Ba23In10Ge10Sb24.79, have been synthesized by using the high temperature solid-state reactions. These new phases exhibit huge unit cells (V = 17 514.6 and 18 455.8 Å3 for Ga- and In-containing compounds, respectively),which comprise 544 atoms and feature “onion-like” M20Ge20Sb30 clusters connected through the Sb–Sb bonds. Among these clusters, substantial isolated units such as Ba, Sb, or Sb3 trimers are filled. With such a complex structure as well as the large unit cell and substantial heavy constituent atoms, ultralow lattice thermal conductivity (κl) was observed for Ba23Ga10Ge10Sb25, ranging from 0.2 to 0.38 W·m–1·K–1 from 323 to 823 K. As a result, a maximun ZT of 0.27 was achieved at 823 K.

中文翻译:

Ba 23 M 10 Ge 10 Sb25 (M = Ga,In)中的超低晶格导热率:包含以Ba为中心的十二面体的四元化合物

利用高温固相反应合成了两种新的季铵化合物Ba 23 Ga 10 Ge 10 Sb 25和Ba 23 In 10 Ge 10 Sb 24.79。这些新的阶段表现出巨大的单元电池(V = 17 514.6和18 455.8埃3为含In GA-和化合物,分别地),其包含544个原子和特征“洋葱状” M 20的Ge 20 Sb的30个通过连接簇Sb–Sb债券。在这些簇中,大量孤立的单元(例如Ba,Sb或Sb 3)三聚体被填充。根据这样的结构复杂,以及大单元细胞和大量的重构成原子,超低晶格热导率(κ)中观察到Ba的2310的Ge 10 Sb的25,为0.2至0.38·W·米-1 ·K从323到823 K时为–1。结果,在823 K时获得的最大ZT为0.27。
更新日期:2018-06-22
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