Thermal Conductivity of Fe-Doped Cosb3 Skutterudites

1998 ◽  
Vol 545 ◽  
Author(s):  
Kevin L. Stokes ◽  
A. C. Ehrlich ◽  
G. S. Nolas
Keyword(s):  
Thermal Conductivity ◽  
Strain Field ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Mass Difference ◽  
Entire Temperature Range ◽  
Polycrystalline Materials ◽  
Conductivity Measurements ◽  
Filled Skutterudite ◽  
Fe Substitution

AbstractWe investigate the effect of Fe substitution for Co on the lattice thermal conductivity of CoSb3 skutterudites. The polycrystalline materials are formed from uniaxially hot-pressed powders. Three alloys were prepared with 0, 3% and 10% Fe, respectively. Thermal conductivity measurements were made between 80 K to 450 K. The lattice thermal conductivity of 10%Fe:CoSb3 is approximately two times smaller than the lattice thermal conductivity of CoSb3 over the entire temperature range. This effect cannot be accounted for by the phenomenlogical theory considering only the mass difference and strain field due to the alloying (Fe) atom. Other phonon scattering mechanisms are discussed. Comparison is made with the partially-filled skutterudite alloy, La0.65Fe2.8Co1.1Sb12.

Lattice Thermal Conductivity Modelling of a Diatomic Nanoscale Material

2020 ◽  
Vol 10 (5) ◽  
pp. 602-609
Author(s):  
Adil H. Awad
Keyword(s):  
Thermal Conductivity ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Correction Term ◽  
Nanoscale Material ◽  
New Approach ◽  
Two Samples ◽  
Conductivity Modelling ◽  
Callaway Model

Introduction: A new approach for expressing the lattice thermal conductivity of diatomic nanoscale materials is developed. Methods: The lattice thermal conductivity of two samples of GaAs nanobeam at 4-100K is calculated on the basis of monatomic dispersion relation. Phonons are scattered by nanobeam boundaries, point defects and other phonons via normal and Umklapp processes. Methods: A comparative study of the results of the present analysis and those obtained using Callaway formula is performed. We clearly demonstrate the importance of the utilised scattering mechanisms in lattice thermal conductivity by addressing the separate role of the phonon scattering relaxation rate. The formulas derived from the correction term are also presented, and their difference from Callaway model is evident. Furthermore their percentage contribution is sufficiently small to be neglected in calculating lattice thermal conductivity. Conclusion: Our model is successfully used to correlate the predicted lattice thermal conductivity with that of the experimental observation.

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.

Theory of Thermal Conductivity of Micro- and Nano-structured Materials

2009 ◽  
Vol 1172 ◽  
Author(s):  
Gyaneshwar P. Srivastava
Keyword(s):  
Thermal Conductivity ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Polycrystalline Diamond ◽  
Comprehensive Treatment ◽  
Si Nanowires ◽  
Quantitative Investigation ◽  
Debye Relaxation ◽  
Structured Materials ◽  
20 Nm

AbstractWe provide a brief discussion of the Boltzmann equation derived Callaway-Debye relaxation time theory of lattice thermal conductivity of micro- and nano-structured materials (of size greater than 20 nm. Incorporated in the theory is a comprehensive treatment of three-phonon scattering events. Using numerical results from this theory, we present a quantitative investigation of the magnitude and temperature variation of the conductivity of CVD polycrystalline diamond films, suspended GaAs nanostructures, Si nanowires, and AlN micro- and nano-ceramics.

Thermal Expansion and Isotopic Composition Effects on Lattice Thermal Conductivities of Crystalline Silicon

2006 ◽  
Author(s):  
Yunfei Chen ◽  
Guodong Wang ◽  
Deyu Li ◽  
Jennifer R. Lukes
Keyword(s):  
Thermal Conductivity ◽  
Thermal Expansion ◽  
Md Simulation ◽  
Lattice Thermal Conductivity ◽  
Mass Difference ◽  
Dynamics Simulation ◽  
Temperature Range ◽  
Simulation Results ◽  
Callaway Model ◽  
Thermal Conductivities

Equilibrium molecular dynamics simulation is used to calculate lattice thermal conductivities of crystal silicon in the temperature range from 400K to 1600K. Simulation results confirmed that thermal expansion, which resulted in the increase of the lattice parameter, caused the decrease of the lattice thermal conductivity. The simulated results proved that thermal expansion imposed another type resistance on phonon transport in crystal materials. Isotopic and vacancy effects on lattice thermal conductivity are also investigated and compared with the prediction from the modified Debye Callaway model. It is demonstrated in the MD simulation results that the isotopic effect on lattice thermal conductivity is little in the temperature range from 400K to 1600K for isotopic concentration below 1%, which implies the isotopic scattering on phonon due to mass difference can be neglected over the room temperature. The remove of atoms from the crystal matrix caused mass difference and elastic strain between the void and the neighbor atoms, which resulted in vacancy scattering on phonons. Simulation results demonstrated this mechanism is stronger than that caused by isotopic scattering on phonons due to mass difference. A good agreement is obtained between the MD simulation results of silicon crystal with vacancy defects and the data predicted from the modified Debye Callaway model. This conclusion is helpful to demonstrate the validity of Klemens' Rayleigh model for impurity scattering on phonons.

scholarly journals Electrical Transport and Thermoelectric Properties of SnSe–SnTe Solid Solution

Materials ◽  
2019 ◽  
Vol 12 (23) ◽  
pp. 3854 ◽  
Author(s):  
Jun-Young Cho ◽  
Muhammad Siyar ◽  
Woo Chan Jin ◽  
Euyheon Hwang ◽  
Seung-Hwan Bae ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Solid Solution ◽  
Electrical Conductivity ◽  
Single Crystal ◽  
Carrier Concentration ◽  
Electrical Transport ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Practical Applications ◽  
Defect Sites

SnSe is considered as a promising thermoelectric (TE) material since the discovery of the record figure of merit (ZT) of 2.6 at 926 K in single crystal SnSe. It is, however, difficult to use single crystal SnSe for practical applications due to the poor mechanical properties and the difficulty and cost of fabricating a single crystal. It is highly desirable to improve the properties of polycrystalline SnSe whose TE properties are still not near to that of single crystal SnSe. In this study, in order to control the TE properties of polycrystalline SnSe, polycrystalline SnSe–SnTe solid solutions were fabricated, and the effect of the solid solution on the electrical transport and TE properties was investigated. The SnSe1−xTex samples were fabricated using mechanical alloying and spark plasma sintering. X-ray diffraction (XRD) analyses revealed that the solubility limit of Te in SnSe1−xTex is somewhere between x = 0.3 and 0.5. With increasing Te content, the electrical conductivity was increased due to the increase of carrier concentration, while the lattice thermal conductivity was suppressed by the increased amount of phonon scattering. The change of carrier concentration and electrical conductivity is explained using the measured band gap energy and the calculated band structure. The change of thermal conductivity is explained using the change of lattice thermal conductivity from the increased amount of phonon scattering at the point defect sites. A ZT of ~0.78 was obtained at 823 K from SnSe0.7Te0.3, which is an ~11% improvement compared to that of SnSe.

scholarly journals Reduction of Lattice Thermal Conductivity in PbTe Induced by Artificially Generated Pores

2015 ◽  
Vol 2015 ◽  
pp. 1-6 ◽  
Author(s):  
Jae-Yeol Hwang ◽  
Eun Sung Kim ◽  
Syed Waqar Hasan ◽  
Soon-Mok Choi ◽  
Kyu Hyoung Lee ◽  
...  
Keyword(s):  
Thermal Conductivity ◽  
Pore Structure ◽  
Transport Properties ◽  
Thermoelectric Materials ◽  
Thermal Transport ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Phonon Modes ◽  
Thermal Transport Properties

Highly dense pore structure was generated by simple sequential routes using NaCl and PVA as porogens in conventional PbTe thermoelectric materials, and the effect of pores on thermal transport properties was investigated. Compared with the pristine PbTe, the lattice thermal conductivity values of pore-generated PbTe polycrystalline bulks were significantly reduced due to the enhanced phonon scattering by mismatched phonon modes in the presence of pores (200 nm–2 μm) in the PbTe matrix. We obtained extremely low lattice thermal conductivity (~0.56 W m−1 K−1at 773 K) in pore-embedded PbTe bulk after sonication for the elimination of NaCl residue.

Phonon scattering due to van der Waals forces in the lattice thermal conductivity of Bi2Te3 thin films

2015 ◽  
Vol 117 (1) ◽  
pp. 015103 ◽  
Author(s):  
Kyeong Hyun Park ◽  
Mohamed Mohamed ◽  
Zlatan Aksamija ◽  
Umberto Ravaioli
Keyword(s):  
Thin Films ◽  
Thermal Conductivity ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Van Der Waals ◽  
Van Der Waals Forces

Vacancy Phonon Scattering and Thermoelectric Properties in In2Te3–SnTe Compounds

2010 ◽  
Vol 650 ◽  
pp. 126-131 ◽  
Author(s):  
Hong Fu ◽  
Peng Zhan Ying ◽  
J.L. Cui ◽  
Y.M. Yan ◽  
X.J. Zhang
Keyword(s):  
Thermal Conductivity ◽  
Thermoelectric Properties ◽  
Point Defects ◽  
Figure Of Merit ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Chemical Compositions ◽  
Thermoelectric Figure ◽  
Solid Solution Formation ◽  
Solution Formation

Solid solution formation is a common and effective way to reduce the lattice thermal conductivity for thermoelectric materials because of additional phonon scattering by point defects and grain boundaries. In the present work we prepared In2Te3–SnTe compounds using a mild solidification technique and evaluated their thermoelectric properties in the temperature range from 318705 K. Measurements reveal that the transport properties are strongly dependent on the chemical composition  In2Te3 content, and lattice thermal conductivity significantly reduces above a minimum In2Te3 concentration, which can possibly be explained by an introduction of the vacancy on the indium sublattice and periodical vacancy planes. The highest thermoelectric figure of merit ZT of 0.19 can be achieved at 705 K, and a big improvement of In2Te3 based alloys would be expected if a proper optimization to the chemical compositions and structures were made.

The lattice thermal conductivity of silver alloys between 0.3 and 4°K

1965 ◽  
Vol 257 (1083) ◽  
pp. 385-407 ◽  
Keyword(s):  
Thermal Conductivity ◽  
Lattice Thermal Conductivity ◽  
Phonon Scattering ◽  
Copper Alloys ◽  
Mean Free Path ◽  
Copper Sample ◽  
Phonon Interaction ◽  
Temperature Range ◽  
Electron Phonon Interaction ◽  
Electrical Resistivities

The thermal and electrical conductivities of silver and copper alloys with high electrical resistivities were studied in the temperature range from 0.3 to 4 °K. The lattice thermal conductivity results were interpreted in terms of Pippard’s semi-classical theory of the electron-phonon interaction and good qualitative agreement between this theory and the measurements was obtained for the temperature range from 1 to 4 °K. Below 1 °K the thermal conductivity of most samples decreased much more rapidly than one would have expected if the phonon mean free path were limited by the electron-phonon interaction only. Other phonon scattering mechanisms were therefore postulated and the effects of phonon scattering from dislocations was studied both theoretically and experimentally. The increase in thermal resistance below 1 °K of most alloys was more rapid than the increase obtained theoretically for phonon-dislocation and phonon-boundary scattering. The thermal conductivity of a copper sample with a resistance ratio of about 85 was found to be anomalous below 1 °K as well, suggesting that both the phonons and the conduction electrons could contribute to the effect in the alloys.

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