Electrical and thermal transport properties of CdO ceramics

High temperature electrical and thermal transport properties, that is, electrical conductivity, Seebeck coefficient and thermal conductivity, of CdO ceramics have been investigated. Because of the good electrical properties and low thermal conductivity, the dimensionless figure-of-merit ZT of the CdO ceramics reaches 0.34 at 1023 K. This value is comparable to the best reported ZT for the n-type oxide ceramic thermoelectric materials and remains as potential to be further improved by porosity controlling or nanostructuring.     

Thermoelectric Figure-of-Merit Calculations in Heavily Doped p-Type Lead Telluride

The thermoelectric properties of heavily doped p-PbTe have been studied theoretically in the temperature range from 300 to 900 K. Calculations are based on a three-band model of the PbTe spectrum that takes the transport of electrons and light holes into account in the L-extrema and heavy holes in the Σ-extrema. On the basis of the Boltzmann kinetic equation, a complete set of relevant kinetic characteristics, including the electrical and thermal conductivities, the Seebeck coefficient, and the thermoelectric figure-of-merit ZT has been calculated. All calculated thermoelectric quantities agree well with the available experimental data in the entire temperature interval from 300 to 900 K. The calculation reproduces a significant increase in the thermoelectric figure-of-merit to the value ZT = 1.2 which has been recently detected experimentally in heavily doped p-PbTe samples.     

Cu addition and its role in thermoelectric properties and nanostructuring in the series compounds (InSb)nCum

We have performed a comparative investigation of the series compounds (InSb)_nCu_m to assess the roles of Cu addition on the thermoelectric properties and nanostructuring in bulk InSb. Detailed temperature dependent transport properties including electrical conductivity, the Seebeck coefficient, and thermal conductivity are presented. The Seebeck coefficients of In₂₀Sb₂₀Cu (m:n = 1:20) are increased by 13 percent in magnitude if compared to those of InSb, which is responsible for the 22 percent enhancement in the highest ZT value at 687 K. Although the magnitudes of κ_L are larger than those of InSb over the entire temperature range, a remarkable reduction in lattice thermal conductivities (κ_L) was observed with measuring temperature elevation. Such changes are mainly due to the precipitation of a large number of Cu₉In₄ nanoparticles with the size of smaller than 5 nm, dispersed in the matrix observed using high resolution transmission electron microscopy (HRTEM) images.     

Thermoelectric effects of a laterally coupled double-quantum-dot structure

We investigate the thermoelectric properties of a laterally coupled double-quantum-dot structure. For this structure, a one-dimensional quantum dot (QD) chain between two leads forms a main channel for electron transmission, and each QD in the chain laterally couples to an additional QD. It is found that at low temperature, similar insulating bands emerge around the antiresonant points in the electronic and thermal conductance spectra. And, the edges of the insulating bands become steep rapidly with the increase of QD numbers. What’s interesting is that striking thermoelectric effect exists in the energy region where the insulating bands appear. Furthermore, with the formation of the insulation bands, the magnitude of the Seebeck coefficient becomes stable, whereas the thermoelectric efficiency is increased. By plotting the Lorentz number spectrum, we observe that in such a structure, the Lorentz number strongly violates the Wiedemann-Franz law in the insulating-band region with its maximum at the point of antiresonance. When weak intradot Coulomb interaction is taken into account, the weakened thermoelectric effect can still be improved with the increase of QD numbers.     

Thermal transport properties in the normal state of CaAlxSi2−x superconductors

Normal state electrical and thermal properties, including electrical resistivity (ρ), Seebeck coefficient (S), and thermal conductivity (κ) of the CaAl_xSi_2−x (x=0.9-1.2) system were investigated. It is found that the electrical resistivity and Seebeck coefficient exhibit a typical metallic character throughout the temperature range investigated, and the metallicity of this series is enhanced with increase in Al/Si ratio. On the other hand, the thermal conductivity shows a weak temperature variation at low temperatures, whereas κ follows a T²-dependence for T>150 K. Analysis of the electronic thermal resistivity based on Klemen’s model reveals that the scattering of electrons from the defects and static imperfections becomes dominant as the temperature approaches T_c. These results are discussed in the light of simultaneous existence of various crystal structures and development of ultra-soft phonon mode recently observed in the CaAlSi system.     

GeI2 monolayer: a model thermoelectric material from 300 to 600 K

ABSTRACT

In this work, the electronic structure, optical properties and thermoelectric properties of the GeI₂ monolayer are calculated by the first principles with the Boltzmann transport equation. The monolayer is calculated as an indirect band gap semiconductor with an indirect band gap of a value 2.19?eV. This GeI₂ monolayer is good for absorbing low-energy photons, and it is insensitive to high-energy photons. The material is stable at temperatures up to 600?K, so we calculated the thermal conductivity (K_L), Seebeck coefficient (S), power factor (PF) and thermoelectric figure of merit (ZT) of the GeI₂ monolayer at various carrier concentrations from 300 to 600?K. Due to the lower group velocity, the GeI₂ monolayer has a lower thermal conductivity of 0.48?W/m?K at 300K. In P-type doping, the power factor can up to 0.11?mW/m?K², and its ZT value is 4.04 at 600?K of the GeI₂ monolayer, indicating that the GeI₂ monolayer is a potential thermoelectric material.     

Thermoelectric properties of CoSb3 with maize‐like structure

Maize‐like CoSb₃ powders were obtained via the chemical alloying method. After the consolidation of the nanopowder using hot press, the CoSb₃ compact shows a higher Seebeck coefficient and lower thermal conductivity. For the investigated CoSb₃, a ZT of 0.15 at 673 K is shown. Though the achieved ZT does not reach the optimal value (0.17 to 0.18) for pure CoSb₃, due to its lower electrical conductivity, the novel structure fabrication provides an interesting and promising approach to enhancing the thermoelectric performance. (© 2007 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim)     

Thermoelectric properties and structural instability of type-I clathrate Ba8Ga16Sn30 at high temperatures

Type-I clathrate Ba₈Ga₁₆Sn₃₀ is known as a typical example showing glass-like behavior in the thermal conductivity at low temperatures. We report on thermoelectric properties above room temperature for the p- and n-type single crystals which were grown from Ga–Sn double flux and Sn single flux, respectively. The measurements of electrical resistivity showed hysteretic behaviors when the sample was heated to 600 K. Powder X-ray diffraction analysis indicated that the type-I structure changed to the type-VIII after the sample was heated to 600 K. By using the data of Seebeck coefficient, electrical resistivity, and thermal conductivity, we estimated the dimensionless figure of merit ZT for the type-I Ba₈Ga₁₆Sn₃₀. For the p- and n-type samples, the values of ZT reach 0.58 and 0.50 at around 450 K, respectively, which values are approximately half of those for the type-VIII counterparts.     

Thermoelectric properties of correlated double quantum dot system in Coulomb blockade regime

We theoretically study thermoelectric properties of a coupled double quantum dot (DQD) system coupled to normal leads using two impurity Anderson model with intra- as well as interdot Coulomb interactions. A generic formulation, which was earlier developed to study electronic properties (zero bias maximum of differential conductance and interesting partial swapping in Fano phenomena) of DQD system within Coulomb blockade regime for a non-magnetic case, is extended to investigate thermoelectric properties i.e. electrical conductance, thermoelectric power and thermal conductance of the same system, as a function of temperature by varying interdot Coulomb interaction and interdot tunneling. Interdot Coulomb interaction is found to trigger some novel features like crossover in thermoelectric power with temperature in all the configurations (series, parallel and T-shape) and a small peak in thermal conductance toward low temperatures, T≈Γ/10, in series and T-shape configurations, which is found to be missing in case of symmetric parallel configuration. The origin of these novel features is attributed to the interplay of renormalization of energy levels caused by the interdot Coulomb interaction which is interpreted in terms of local density of states and the asymmetry effects related to dot-lead couplings/interference effects.     

Thermoelectric properties of Ni-doped CuInTe2

Polycrystalline samples of composition Cu_1−xNi_xInTe₂ (for x=0–0.05) were synthesized from elements of 5 N purity using a solid-state reaction. The phase purity of the products was verified by X-ray diffraction. Samples for measurement of the transport properties were prepared using hot-pressing. The samples were then characterized by the measurement of electrical conductivity, the Hall coefficient, the Seebeck coefficient, and the thermal conductivity over a temperature range of 300–675 K. All of the samples demonstrate p-type conductivity. We discuss the influence of Ni substitution on the free carrier concentration and the thermoelectric performance. The investigation of the thermoelectric properties shows an improvement up to 50% of ZT in the temperature range of 300–600 K.     

Low temperature thermoelectric properties of Bi2−xSbxTeSe2 crystals near the n–p crossover

Seebeck coefficients, electrical resistivities, thermal conductivities and figure of merit ZT of Bi_2?xSb_xTeSe₂ crystals (x=0.8, 0.9, 1.0, 1.1, and 1.2) measured along the hexagonal basal plane are presented. The crystals gradually change from n- to p-type with increasing Sb content, with the crossover lying in the region between x=1.0 and 1.1. The crossover is accounted for by a simple (p–n) electron-hole compensation model, as supported by carrier concentrations determined from Hall measurements. ZT was found to be maximized near the crossover on the p-type side, with the high electrical resistance of the Se-rich crystals apparently the limiting factor in the performance. These materials may serve as a basis for future nanostructuring or doping studies.     

Thermoelectric properties and electronic structure of Al-doped ZnO

Impure ZnO materials are of great interest for high temperature thermoelectric application. In this work, we present the effects of Al-doping on the thermoelectric properties and electronic structures of a ZnO system. We find that, with increasing Al concentrations, the electrical conductivity increases and the thermal conductivity decreases significantly, whereas, the Seebeck coefficient decreases slightly. Nevertheless, the figure of merit (ZT) increases owing to high electrical conductivity and low thermal conductivity. On the other hand, the electronic band structures show that the position of the Fermi level is moved upwards and the bands split near the valence-band top and conduction-band bottom. This is due to the interaction between the Al3p and Zn4s orbitals, which drive the system towards semimetal. Besides, the Density Of States (DOS) analysis shows that the introduction of Al atom obviously reduces the slope d(DOS)/dE near the Fermi level. Based on the calculated band structures, we are able to explain qualitatively the measured transport properties of the Al-doped ZnO system.     

Combinatorial synthesis and high throughput evaluation of thermoelectric power factor in Mg-Si-Ge ternary compounds

Discrete phase libraries of thermoelectric compounds, Mg_xSi_yGe_1−y, were fabricated by a combinatorial pulsed laser deposition followed by annealing as a thin film form on an integrated ceramic substrate. In the substrate are embedded four probe electrical contacts to each sample, lead wires and pads to be accessed by needle probes. Resistivity and Seebeck coefficient were evaluated electrically, while temperature difference was locally given to each sample by a local heater also embedded in the substrate. The sample temperature (300-673 K) was controlled by a heating stage and temperature difference at the two contact points for each sample was evaluated by an infrared camera. The dependences of polarity and absolute values of Seebeck coefficient on the composition agree well with the data in literature.     

Enhanced Seebeck effect in graphene devices by strain and doping engineering

In this work, we investigate the possibility of enhancing the thermoelectric power (Seebeck coefficient) in graphene devices by strain and doping engineering. While a local strain can result in the misalignment of Dirac cones of different graphene sections in the k-space, doping engineering leads to their displacement in energy. By combining these two effects, we demonstrate that a conduction gap as large as a few hundred meV can be achieved and hence the enhanced Seebeck coefficient can reach a value higher than 1.4 mV/K in graphene doped heterojunctions with a locally strained area. Such hetero-channels appear to be very promising for enlarging the applications of graphene devices as in strain and thermal sensors.     

Highly enhanced thermoelectric figure of merit of a β-SiC nanowire with a nanoelectromechanical measurement approach

We developed a reliable and highly reproducible way of fabricating a one-stop measurement platform for characterizing the thermoelectric properties of individual nanowires (NWs) using a focused ion beam and a nanomanipulator. 3-ω and 1-ω signals obtained by the four-point-probe method were used in measuring the thermal and electrical conductivities of the NW. Subsequently, the Seebeck coefficient was measured by using additional nanoelectrodes including a nanoheater. The thermal conductivity of the single β-SiC NW was obtained at 86.5±3.5 W/mK. The Seebeck coefficient was obtained to be −1.21 mV/K by using the same measurement platform. Thus, the dimensionless figure of merit, ZT=σS ² T/k, was measured to be ∼0.12. This value is around 120 times higher than the reported maximum value of bulk β-SiC.     

Spin-dependent Kondo effect induced by Rashba spin-orbit interaction in parallel coupled double quantum dots

Electronic transport through parallel coupled double quantum dots (DQD) with Rashba spin-orbit (RSO) interaction is investigated in Kondo regime by means of the slave-boson mean field approximation at zero temperature. By the co-action of the phase factor deduced by RSO interaction and the magnetic flux penetrating the parallel DQD, an interesting spin-dependent Kondo effect emerges. The molecular state representation theory is used to obtain a detailed understanding of the spin-dependent Kondo effect. It is shown that Quantum interference between the bonding Kondo state and antibonding state, which is modulated by the RSO interaction, plays a crucial role to the density of states and the linear conductance. The magnitude of each spin component conductance can be modulated by the RSO interaction strength. The conductance of each spin component exhibits 4π-periodic function with respect to φR. Moreover, the swap operation in the parallel DQD system can be implemented by tuning the RSO interaction.     

High‐temperature thermoelectric properties of Cu2In4Te7

Cu₂Ga₄Te₇ has recently been reported to have a relatively high thermoelectric (TE) figure of merit (ZT). However, the TE properties of Cu₂In₄Te₇, which has the same defect zinc‐blende structure as Cu₂Ga₄Te₇, have been hardly investigated. Here, we demonstrate that Cu₂In₄Te₇ has relatively high ZT values that are similar to those of Cu₂Ga₄Te₇. High‐density polycrystalline bulk samples of Cu₂In₄Te₇ were prepared and their electrical resistivity (?), Seebeck coefficient (S), and thermal conductivity (κ) were measured. Cu₂In₄Te₇ has a maximum ZT of 0.3 at 700 K, with ?, S, and κ values of 62.1 × 10^–5 Ω m, 394 μV K^–1, and 0.61 W m^–1 K^–1, respectively. (© 2012 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim)     

熔体旋甩法合成n型(Bi_(0.85)Sb_(0.15))_2(Te_(1-x)Se_x)_3化合物的微结构及热电性能

采用熔体旋甩结合放电等离子烧结(MS-SPS)技术制备了单相n型四元(Bi0.85Sb0.15)2(Te1-xSex)3(x=0.15,0.17,0.19,0.21)化合物,并对所得样品的微结构和热电传输性能进行了系统研究.样品自由断裂面的场发射扫描电子显微镜及抛光面的背散射电子成分分析表明:块体材料晶粒细小,晶粒排列紧密,成分分布均匀且相结构单一,样品中存在大量10—100nm的层状结构.随着Se含量x的增加,样品的电导率和热导率逐渐增加,而Seebeck系数逐渐降低.相比商业应用的区熔材料,MS-SPS方法合成的高Se组成的样品均在425K后表现出更高的ZT值,其中(Bi0.85Sb0.15)2(Te0.83Se0.17)3样品具有最高的ZT值,在360K可达到0.96,并在320—500K均保持较高的ZT值,500K时其ZT值相比区熔材料提高了48%.此外,通过调节Se的含量,可以有效地调控材料的ZT峰值出现的温度段,这对多级或梯度热电器件的制备具有重要意义.     

Thermoelectric properties of Ca3−xYxCo4O9+δ ceramics

The Ca_3?xY_xCo₄O_9+δ (x=0, 0.15, 0.3) ceramics were prepared by combining the polyacrylamide gel method and the spark plasma sinter (SPS) technology in order to improve the thermoelectric properties of Ca₃Co₄O_9+δ ceramics. The Seebeck coefficients and the resistivities of the Y-doped samples were obviously enhanced due to the decrease of carrier concentration, and their thermal conductivities were decreased due to the impurity scattering effect. The thermoelectric properties were improved at high temperature by Y-doping according to the power factor analysis and the thermoelectric figure of merit (ZT) data. The optimized figure of merit ZT=0.22 at 973 K was obtained for Ca_2.7Y_0.3Co₄O_9+δ.     

High‐temperature thermoelectric properties of p‐type skutterudites Ybx Co3FeSb12

Partially filled polycrystalline p‐type skutterudites of nominal compositions Yb_x Co₃FeSb₁₂ were synthesized and their thermoelectric properties characterized. The compositions and filling fractions were confirmed with a combination of Rietveld refinement and elemental analysis. The thermoelectric properties were evaluated from 300 K to 810 K. The Seebeck coefficient and resistivity increase while the thermal conductivity decreases with increasing Yb content. A maximum ZT value of 0.85 was obtained at 810 K. This work is part of a continuing effort to enhance the thermoelectric properties of p‐type skutterudites, as this class of materials continues to be of interest for thermoelectrics applications. (© 2013 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim)