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Thermodynamically metastable skutterudite crystalline-structured compounds

机译:热力学亚稳态方钴矿晶体结构化合物

摘要

Thermodynamically metastable skutterudite crystalline- structured compounds are disclosed having preselected stoichiometric compositions and superior and optimizable thermoelectric properties. The compounds are formed at low nucleation temperatures and satisfy the formula:P P M.sub.1-x M'.sub.4-y Co.sub.y M".sub.12 PP wherein:PPM=any metal, metalloid, or mixture thereof, except for La, Ce, Pr, Nd, and Eu when x=0, and M'=Fe, Ru, or Os, and M"=Sb, P, or As;PPM'=Fe, Ru, Os, Rh, or mixture thereof; PPM"Sb, As, P, Bi, Ge.sub.0.5-w Se.sub.0. 5+w, wherein w=0 to 0.5 or mixture thereof;PPx=0 to 1; PP y=0 to 4; andPPwherein M' and/or M" are doped or undoped. These compounds generally have the crystalline structure of a skutterudite, wherein the crystalline structure is cubic with 34 atoms in the unit-cell in the space group Im3. The M".sub.12 atoms occupy unit- cell sites 24(g), the M'.sub.4-y atoms form a cubic sublattice occupying unit-cell sites 8(c), and the M.sub.1-x atoms are positioned in two remaining "holes" or interstitial sites in the unit- cell, namely sites 2(a). These thermodynamically metastable skutterudite crystalline- structured compounds possess relatively low thermal conductivity properties with relatively high electrical conductivity properties, making the compounds ideal for use in thermoelectric devices.
机译:公开了具有预选择的化学计量组成和优异且可优化的热电性质的热力学亚稳态方钴矿晶体结构化合物。该化合物在低成核温度下形成并满足下式:

M.sub.1-x M'.sub.4-y Co.sub.y M“ .sub.12

M“ Sb,As,P,Bi,Ge.sub.0.5-w Se.sub.0。5 + w,其中w = 0-0.5或其混合物;

x = 0至1;

y = 0至4;并且

其中M′和/或M”被掺杂或不掺杂。这些化合物通常具有方钴矿的晶体结构,其中该晶体结构是立方的,在空间群Im3中的晶胞中具有34个原子。 M” .sub.12原子占据晶胞位点24(g),M'sub.4-y原子形成立方亚晶格占据晶胞位点8(c),M'sub.1- x原子位于晶胞中两个剩余的“孔”或间隙位置,即位点2(a)。这些热力学亚稳态方钴矿晶体结构化合物具有相对较低的热导率特性和相对较高的电导率特性,使得这些化合物适用于热电设备。

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