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We use a magnetothermal resistance method to measure lattice thermal conductivity of pure single crystal metals over a wide range of temperatures. Large transverse magnetic fields are applied to suppress electronic thermal conduction. The…

Materials Science · Physics 2017-10-25 Mengliang Yao , Mona Zebarjadi , Cyril P. Opeil

Thermal transport in highly anharmonic, amorphous, or alloyed materials often deviates from the predictions of conventional phonon-based models. First-principles approaches have introduced a coherent contribution to account for these…

Materials Science · Physics 2025-11-26 Đorđe Dangić

Thermoelectric transport coefficients are determined for semiconductor quantum wires with weak thickness fluctuations. Such systems exhibit anomalies in conductance near 1/4 and 3/4 of 2e^2/h on the rising edge to the first conductance…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 T. Rejec , A. Ramsak , J. H. Jefferson

On the basis of the linear response transport theory, the general expressions for the thermoelectric transport coefficients, such as thermoelectric power (S), Nernst coefficient (\nu), and thermal conductivity (\kappa), are derived by using…

Strongly Correlated Electrons · Physics 2009-11-07 Hiroshi Kontani

Diminution of the thermal conductivity is a crucial aspect in thermoelectric research. We report a systematic and significant reduction of the cross-plane thermal conductivity in a model system consisting of DC sputtered TiNiSn and HfNiSn…

We have combined the Boltzmann transport equation with an {\it ab initio} approach to compute the thermoelectric coefficients of semiconductors. Electron-phonon, ionized impurity, and electron-plasmon scattering rates have been taken into…

Materials Science · Physics 2018-10-26 Z. Wang , S. Wang , S. Obukhov , N. Vast , J. Sjakste , V. Tyuterev , N. Mingo

We calculate the thermal conductivity of interacting electrons in disordered metals. In our analysis we point out that the interaction affects thermal transport through two distinct mechanims, associated with quantum interference…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Roberto Raimondi , Giorgio Savona , Peter Schwab , Thomas Lueck

We present an ab initio study of the structural and electronic transport properties of tetrahedrite, Cu$_{12}$Sb$_4$S$_{13}$, in its high-temperature phase. We show how this complex compound can be seen as the outcome of an ordered…

Materials Science · Physics 2020-07-07 Cono di Paola , Francesco Macheda , Savio Laricchia , Cedric Weber , Nicola Bonini

The shandite family of solids, with hexagonal structure and composition A3M2X2 (A = Ni,Co,Rh,Pd; M = Pb,In,Sn,Tl; X = S,Se), has attracted recent research attention due to promising applications as thermoelectric materials. Herein we…

Materials Science · Physics 2016-11-23 Alex Aziz , Panagiotis Mangelis , Paz Vaqueiro , Anthony V. Powell , Ricardo Grau-Crespo

The first order standard perturbation theory combined with ab initio projector augmented wave operator challenges the realization of the standard Sternheimer equation with linear computational efficiency. This efficiency motivates us to…

Materials Science · Physics 2018-10-05 Sushant Kumar Behera , Pritam Deb

For high efficiency thermoelectric power conversion not only improvement of materials properties but also prediction and synthesis of new thermoelectric materials is needed. Here we have carried out a systematic investigation on…

Materials Science · Physics 2021-01-25 Jayanta Bera , Atanu Betal , Satyajit Sahu

We propose a new method for accurately calculating electrical transport properties of a lightly-doped thermoelectric material from density functional theory (DFT) calculations, based on experimental data and density functional theory…

Materials Science · Physics 2014-01-14 Alireza Faghaninia , Cynthia S. Lo

Fabrication and characterization of instrument for high-temperature simultaneous measurement of Seebeck coefficient (S) and thermal conductivity ($\kappa$) has been carried out with python automation. The steady-state based Fourier's law of…

Materials Science · Physics 2022-04-20 Shamim Sk , Abhishek Pandey , Sudhir K. Pandey

In the organic superconducting \kappa-(BEDT-TTF) compounds, various transport phenomena exhibit striking non-Fermi liquid behaviors, which should be the important clues to understanding the electronic state of this system. Especially, the…

Superconductivity · Physics 2009-10-31 H. Kontani , H. Kino

We conduct comprehensive investigations of both thermal and electrical transport properties of SnSe and SnS using first-principles calculations combined with the Boltzmann transport theory. Due to the distinct layered lattice structure,…

Materials Science · Physics 2015-10-14 Ruiqiang Guo , Xinjiang Wang , Youdi Kuang , Baoling Huang

Thermal conductivity $\kappa_{xx}(T)$ under a field is investigated in $d_{x^2-y^2}$-wave superconductors and isotropic s-wave superconductors by the linear response theory, using a microscopic wave function of the vortex lattice states. To…

Superconductivity · Physics 2009-11-07 Mitsuaki Takigawa , Masanori Ichioka , Kazushige Machida

We present systematic theoretical results on thermoelectric effects in semimetals based on the variational method of the linearized Boltzmann equation. Inelastic electron-hole scattering is known to play an important role in the unusual…

Strongly Correlated Electrons · Physics 2023-03-31 Keigo Takahashi , Hiroyasu Matsuura , Hideaki Maebashi , Masao Ogata

We have studied the effect of strong magnetic field on the charge and thermal transport properties of hot QCD matter at finite chemical potential. For this purpose, we have calculated the electrical ($\sigma_{\rm el}$) and thermal…

High Energy Physics - Phenomenology · Physics 2021-02-03 Shubhalaxmi Rath , Binoy Krishna Patra

High electric conductivity ~100 MegaSiemens/m and Seebeck coefficient >200 mkV/K of carbon nanotubes (CNT) make them attractive for a variety of applications. Unfortunately, a high thermal conductivity ~ 3000 W/(m*K) due to the phonon…

Mesoscale and Nanoscale Physics · Physics 2016-11-10 T. Gupta , I. P. Nevirkovets , V. Chandrasekhar , S. Shafranjuk

Motivated by recent investigations of transport properties of strongly correlated 1d models and thermal conductivity measurements of quasi 1d magnetic systems we present results for the integrable spin-1/2 $XXZ$ chain. The thermal…

Statistical Mechanics · Physics 2019-12-20 Andreas Kluemper , Kazumitsu Sakai