scholarly journals Cu8GeSe6-based thermoelectric materials with an argyrodite structure

2017 ◽  
Vol 5 (4) ◽  
pp. 943-952 ◽  
Author(s):  
Binbin Jiang ◽  
Pengfei Qiu ◽  
Espen Eikeland ◽  
Hongyi Chen ◽  
Qingfeng Song ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Thermoelectric Material ◽  
Thermoelectric Materials ◽  
Lattice Thermal Conductivity ◽  
Thermoelectric Performance ◽  
Type Compound

Cu8GeSe6 argyrodite-type compound is a new thermoelectric material which exhibits extremely low lattice thermal conductivity and high thermoelectric performance.

An argyrodite-type Ag9GaSe6 liquid-like material with ultralow thermal conductivity and high thermoelectric performance

2017 ◽  
Vol 53 (85) ◽  
pp. 11658-11661 ◽  
Author(s):  
Binbin Jiang ◽  
Pengfei Qiu ◽  
Hongyi Chen ◽  
Qihao Zhang ◽  
Kunpeng Zhao ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Thermoelectric Material ◽  
Lattice Thermal Conductivity ◽  
Thermoelectric Performance ◽  
Type Compound

Ag9GaSe6 argyrodite-type compound is a promising thermoelectric material which exhibits ultralow lattice thermal conductivity and high thermoelectric performance.

Metal phosphide CuP2 as a promising thermoelectric material: an insight from first-principles study

2021 ◽  
Author(s):  
Un-Gi Jong ◽  
Chol-Hyok Ri ◽  
Chol-Jin Pak ◽  
Chol-Hyok Kim ◽  
Stefaan Cottenier ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Thermoelectric Material ◽  
Thermoelectric Materials ◽  
First Principles ◽  
Lattice Thermal Conductivity ◽  
Metal Phosphide ◽  
First Principles Study ◽  
Metal Phosphides ◽  
Large Lattice

In the search for better thermoelectric materials, metal phosphides have not been considered to be viable candidates so far, due to their large lattice thermal conductivity. Here we study thermoelectric...

scholarly journals Achieving High Thermoelectric Performance in Rare-Earth Element-Free CaMg2Bi2 with High Carrier Mobility and Ultralow Lattice Thermal Conductivity

Research ◽  
2020 ◽  
Vol 2020 ◽  
pp. 1-10 ◽  
Author(s):  
Muchun Guo ◽  
Fengkai Guo ◽  
Jianbo Zhu ◽  
Li Yin ◽  
Qian Zhang ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Thermoelectric Materials ◽  
Carrier Mobility ◽  
Lattice Thermal Conductivity ◽  
Low Cost ◽  
Thermoelectric Performance ◽  
Widespread Application ◽  
Compatibility Factor ◽  
High Carrier Mobility ◽  
High Carrier

CaMg2Bi2-based compounds, a kind of the representative compounds of Zintl phases, have uniquely inherent layered structure and hence are considered to be potential thermoelectric materials. Generally, alloying is a traditional and effective way to reduce the lattice thermal conductivity through the mass and strain field fluctuation between host and guest atoms. The cation sites have very few contributions to the band structure around the fermi level; thus, cation substitution may have negligible influence on the electric transport properties. What is more, widespread application of thermoelectric materials not only desires high ZT value but also calls for low-cost and environmentally benign constituent elements. Here, Ba substitution on cation site achieves a sharp reduction in lattice thermal conductivity through enhanced point defects scattering without the obvious sacrifice of high carrier mobility, and thus improves thermoelectric properties. Then, by combining further enhanced phonon scattering caused by isoelectronic substitution of Zn on the Mg site, an extraordinarily low lattice thermal conductivity of 0.51 W m-1 K-1 at 873 K is achieved in (Ca0.75Ba0.25)0.995Na0.005Mg1.95Zn0.05Bi1.98 alloy, approaching the amorphous limit. Such maintenance of high mobility and realization of ultralow lattice thermal conductivity synergistically result in broadly improvement of the quality factor β. Finally, a maximum ZT of 1.25 at 873 K and the corresponding ZTave up to 0.85 from 300 K to 873 K have been obtained for the same composition, meanwhile possessing temperature independent compatibility factor. To our knowledge, the current ZTave exceeds all the reported values in AMg2Bi2-based compounds so far. Furthermore, the low-cost and environment-friendly characteristic plus excellent thermoelectric performance also make the present Zintl phase CaMg2Bi2 more competitive in practical application.

scholarly journals Zintl-phase Eu2ZnSb2: A promising thermoelectric material with ultralow thermal conductivity

2019 ◽  
Vol 116 (8) ◽  
pp. 2831-2836 ◽  
Author(s):  
Chen Chen ◽  
Wenhua Xue ◽  
Shan Li ◽  
Zongwei Zhang ◽  
Xiaofang Li ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Thermoelectric Material ◽  
Thermoelectric Materials ◽  
Lattice Thermal Conductivity ◽  
Domain Boundary ◽  
Zn Deficiency ◽  
Zintl Phase ◽  
Medium Temperature ◽  
Inversion Domain ◽  
Electron Crystal

Zintl compounds are considered to be potential thermoelectric materials due to their “phonon glass electron crystal” (PGEC) structure. A promising Zintl-phase thermoelectric material, 2-1-2–type Eu2ZnSb2 (P63/mmc), was prepared and investigated. The extremely low lattice thermal conductivity is attributed to the external Eu atomic layers inserted in the [Zn2Sb2]2- network in the structure of 1-2-2–type EuZn2Sb2(P3¯m1), as well as the abundant inversion domain boundary. By regulating the Zn deficiency, the electrical properties are significantly enhanced, and the maximum ZT value reaches ∼1.0 at 823 K for Eu2Zn0.98Sb2. Our discovery provides a class of Zintl thermoelectric materials applicable in the medium-temperature range.

Thermoelectric Performance of ZrNX (X = Cl, Br, I) Monolayers

2021 ◽  
Author(s):  
Wenwu Shi ◽  
Nina Ge ◽  
Xinzhong Wang ◽  
Zhiguo Wang
Keyword(s):  
Thermal Conductivity ◽  
Power Factor ◽  
High Power ◽  
Thermoelectric Materials ◽  
Lattice Thermal Conductivity ◽  
Thermoelectric Performance ◽  
Low Thermal Conductivity ◽  
High Power Factor

Low thermal conductivity and high power factor are essential for the efficient thermoelectric materials. The lattice thermal conductivity can be reduced by reducing the dimension of materials, thus improving the...

scholarly journals Lead-free SnTe-based thermoelectrics: enhancement of thermoelectric performance by doping with Gd/Ag

2016 ◽  
Vol 4 (20) ◽  
pp. 7936-7942 ◽  
Author(s):  
Lijuan Zhang ◽  
Jianli Wang ◽  
Zhenxiang Cheng ◽  
Qiao Sun ◽  
Zhen Li ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Seebeck Coefficient ◽  
Thermoelectric Materials ◽  
Lattice Thermal Conductivity ◽  
Lead Free ◽  
Thermoelectric Performance ◽  
Co Doping

Gd/Ag co-doping is an effective way to simultaneously reduce the lattice thermal conductivity and enhance the Seebeck coefficient of SnTe-based thermoelectric materials.

Efficient lanthanide Gd Doping Promoting Thermoelectric Performance of Mg3Sb2-based Materials

2021 ◽  
Author(s):  
Jingdan Lei ◽  
Hexige Wuliji ◽  
Kunpeng Zhao ◽  
Tian-Ran Wei ◽  
Qing Xu ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Thermoelectric Materials ◽  
Carrier Mobility ◽  
Lattice Thermal Conductivity ◽  
Thermoelectric Performance ◽  
High Carrier Mobility ◽  
High Carrier ◽  
High Band

Mg3Sb2-based thermoelectric materials have recently received heightened attentions due to its diverse merits of high band degeneracy, ultralow lattice thermal conductivity and high carrier mobility. However, the inherently low carrier...

scholarly journals The origin of the lattice thermal conductivity enhancement at the ferroelectric phase transition in GeTe

2021 ◽  
Vol 7 (1) ◽  
Author(s):  
Đorđe Dangić ◽  
Olle Hellman ◽  
Stephen Fahy ◽  
Ivana Savić
Keyword(s):  
Phase Transition ◽  
Thermal Conductivity ◽  
Phase Transitions ◽  
Thermoelectric Materials ◽  
Ferroelectric Phase Transition ◽  
Lattice Thermal Conductivity ◽  
Ferroelectric Phase ◽  
Structural Phase ◽  
High Symmetry ◽  
Structural Phase Transitions

AbstractThe proximity to structural phase transitions in IV-VI thermoelectric materials is one of the main reasons for their large phonon anharmonicity and intrinsically low lattice thermal conductivity κ. However, the κ of GeTe increases at the ferroelectric phase transition near 700 K. Using first-principles calculations with the temperature dependent effective potential method, we show that this rise in κ is the consequence of negative thermal expansion in the rhombohedral phase and increase in the phonon lifetimes in the high-symmetry phase. Strong anharmonicity near the phase transition induces non-Lorentzian shapes of the phonon power spectra. To account for these effects, we implement a method of calculating κ based on the Green-Kubo approach and find that the Boltzmann transport equation underestimates κ near the phase transition. Our findings elucidate the influence of structural phase transitions on κ and provide guidance for design of better thermoelectric materials.

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