Improving the thermoelectric performance of Cu2SnSe3via regulating micro- and electronic structures

Nanoscale ◽  
2021 ◽  
Vol 13 (7) ◽  
pp. 4233-4240
Author(s):  
Hongwei Ming ◽  
Chen Zhu ◽  
Xiaoying Qin ◽  
Bushra Jabar ◽  
Tao Chen ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Electronic Structure ◽  
Power Factor ◽  
Electronic Structures ◽  
Mechanical Milling ◽  
Lattice Thermal Conductivity ◽  
Thermoelectric Performance ◽  
Structure Modulation

A 2.3-fold rise in power factor and 40% drop in the lattice thermal conductivity is realized through micro- and electronic structure modulation with mechanical milling, leading to a large ZT = 0.9 for Cu2SnSe3.

A High Thermoelectric Performance ZT in p-Type LaSe2 Crystal

2021 ◽  
Vol 871 ◽  
pp. 203-207
Author(s):  
Jian Liu
Keyword(s):  
Thermal Conductivity ◽  
Power Factor ◽  
High Power ◽  
Density Functional ◽  
Lattice Thermal Conductivity ◽  
Phonon Transport ◽  
Thermoelectric Performance ◽  
Boltzmann Transport ◽  
High Power Factor ◽  
P Type

In this work, we use first principles DFT calculations, anharmonic phonon scatter theory and Boltzmann transport method, to predict a comprehensive study on the thermoelectric properties as electronic and phonon transport of layered LaSe2 crystal. The flat-and-dispersive type band structure of LaSe2 crystal offers a high power factor. In the other hand, low lattice thermal conductivity is revealed in LaSe2 semiconductor, combined with its high power factor, the LaSe2 crystal is considered a promising thermoelectric material. It is demonstrated that p-type LaSe2 could be optimized to exhibit outstanding thermoelectric performance with a maximum ZT value of 1.41 at 1100K. Explored by density functional theory calculations, the high ZT value is due to its high Seebeck coefficient S, high electrical conductivity, and low lattice thermal conductivity .

Enhanced thermoelectric performance through carrier scattering at heterojunction potentials in BiSbTe based composites with Cu3SbSe4 nanoinclusions

2015 ◽  
Vol 3 (27) ◽  
pp. 7045-7052 ◽  
Author(s):  
Yuanyue Li ◽  
Di Li ◽  
Xiaoying Qin ◽  
Xiuhui Yang ◽  
Yongfei Liu ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Power Factor ◽  
Figure Of Merit ◽  
Lattice Thermal Conductivity ◽  
Thermoelectric Performance ◽  
Thermoelectric Figure Of Merit ◽  
Thermoelectric Figure ◽  
Carrier Scattering ◽  
Interface Scattering

Owing to enhanced power factor and reduced lattice thermal conductivity through interface scattering, a largest thermoelectric figure of merit ZT = 1.61 is achieved at 467 K for BiSbTe based composite with Cu3SbSe4 nanoinclusions.

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...

Germanium Chalcogenide Thermoelectrics: Electronic Structure Modulation and Low Lattice Thermal Conductivity

2018 ◽  
Vol 30 (17) ◽  
pp. 5799-5813 ◽  
Author(s):  
Subhajit Roychowdhury ◽  
Manisha Samanta ◽  
Suresh Perumal ◽  
Kanishka Biswas
Keyword(s):  
Thermal Conductivity ◽  
Electronic Structure ◽  
Lattice Thermal Conductivity ◽  
Structure Modulation

scholarly journals Strategy of extra Zr doping on the enhancement of thermoelectric performance for TiZrxNiSn synthesized by a modified solid-state reaction

2021 ◽  
Author(s):  
Jun-Liang Chen ◽  
Hengquan Yang ◽  
Chengyan Liu ◽  
Jisheng Liang ◽  
Lei Miao ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Solid State ◽  
Power Factor ◽  
Solid State Reaction ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Heusler Alloys ◽  
Thermoelectric Performance ◽  
Good Mechanical Property ◽  
Large Power

Abstract Half-Heusler alloys, which possess the advantages of high thermal stability, large power factor and good mechanical property, have been attracted increasing interest in mid-temperature thermoelectric application. In this work, the extra Zr-doped TiZrxNiSn samples were successfully prepared by a modified solid-state reaction followed by spark plasma sintering. It demonstrates that extra Zr doping could not only improve the power factor on account of an increase in Seebeck coefficient but also suppress the lattice thermal conductivity originated from the strengthened phonon scattering by the superlattice nanodomains and the secondary nanoparticles. As a consequence, an increased power factor of 3.29 mW m− 1 K− 2 and a decreased lattice thermal conductivity of 1.74 W m− 1 K− 1 are achieved in TiZr0.015NiSn, leading to a peak ZT as high as 0.88 at 773 K and an average ZT value up to 0.62 in the temperature range of 373 − 773 K. This work gives a guidance for optimizing the thermoelectric performance of TiNiSn-based alloys by modulating the microstructures on the secondary nanophases and superlattice nanodomains.

Enhanced thermoelectric performance of band structure engineered GeSe1−xTex alloys

2021 ◽  
Vol 5 (6) ◽  
pp. 1734-1746
Author(s):  
D. Sidharth ◽  
A. S. Alagar Nedunchezhian ◽  
R. Akilan ◽  
Anup Srivastava ◽  
Bhuvanesh Srinivasan ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Band Structure ◽  
Power Factor ◽  
Thermoelectric Performance

The power factor of GeSe enhanced and thermal conductivity decreased by Te substitution and thereby, GeSe0.80Te0.20 exhibits high ZT.

scholarly journals A Material Catalogue with Glass-Like Thermal Conductivity Mediated by the Crystallographic Occupancy for Thermoelectric Application

2021 ◽  
Author(s):  
Zihang Liu ◽  
Wenhao Zhang ◽  
Weihong Gao ◽  
Takao Mori
Keyword(s):  
Thermal Conductivity ◽  
Lattice Thermal Conductivity ◽  
Thermoelectric Performance ◽  
Synthetic Approach ◽  
Thermoelectric Application

Discovering materials with the intrinsically low lattice thermal conductivity κlat is an important route for achieving high thermoelectric performance. In reality, the conventional synthetic approach, however, relies on trial and...

scholarly journals First-principles predictions of low lattice thermal conductivity and high thermoelectric performance of AZnSb (A = Rb, Cs)

RSC Advances ◽  
2021 ◽  
Vol 11 (25) ◽  
pp. 15486-15496
Author(s):  
Enamul Haque
Keyword(s):  
Thermal Conductivity ◽  
Debye Temperature ◽  
Layered Structure ◽  
First Principles ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Thermoelectric Performance

The layered structure, and presence of heavier elements Rb/Cs and Sb induce high anharmonicity, low Debye temperature, intense phonon scattering, and hence, low lattice thermal conductivity.

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