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PdTe$_2$ is a type II Dirac semimetal that has garnered significant attention due to its intriguing electronic and topological properties. Here, we report temperature dependent Raman scattering study of PdTe$_2$ in the temperature range…

Strongly Correlated Electrons · Physics 2025-06-27 Bharathiganesh Devanarayanan , Sahil Rathi , Jalaja Pandya , Sonika , C. S. Yadav , Navinder Singh , Satyendra Nath Gupta

Lattice thermal conductivities (LTC) for a subset of polymer crystals from the Polymer Genome Library were investigated to explore high LTC polymer systems. We employed a first-principles approach to evaluating phonon lifetimes within the…

Materials Science · Physics 2020-08-21 Keishu Utimula , Tom Ichibha , Ryo Maezono , Kenta Hongo

Recent theoretical and experimental research suggests that $\theta$-TaN is a semimetal with high thermal conductivity ($\kappa$), primarily due to the contribution of phonons ($\kappa_\texttt{ph}$). By using first-principles calculations,…

Materials Science · Physics 2024-03-20 Ashis Kundu , Yani Chen , Xiaolong Yang , Fanchen Meng , Jesús Carrete , Mukul Kabir , Georg K. H. Madsen , Wu Li

In conventional metals, thermal transport is governed by electrons, with phonon contributions often considered negligible. Here, through rigorous first-principles calculations, we uncover a phonon-dominated thermal transport regime in the…

Materials Science · Physics 2026-01-13 Xianyong Ding , Xin Jin , Dengfeng Li , Jing Fan , Peng Yu , Xiaoyuan Zhou , Xiaolong Yang , Rui Wang

Probing phonons, quasi-particle excitations and their coupling has enriched our understanding of these 2D materials and proved to be crucial for developing their potential applications. Here, we report comprehensive temperature, 4-330 K,…

Materials Science · Physics 2022-03-14 Deepu Kumar , Vivek Kumar , Rahul Kumar , Mahesh Kumar , Pradeep Kumar

We present low-temperature Raman measurements on gate tunable graphene encapsulated in hexagonal boron nitride, which allows to study in detail the Raman G and 2D mode frequencies and line widths as function of the charge carrier density.…

Mesoscale and Nanoscale Physics · Physics 2023-02-15 Jens Sonntag , Kenji Watanabe , Takashi Taniguchi , Bernd Beschoten , Christoph Stampfer

The mean free path of photocarriers is a crucial parameter for material design, device optimization, and new optoelectronics applications. Currently, this parameter remains unknown for many materials, and experimental means available for…

Optics · Physics 2026-01-06 Zuni Luo , Yifan Zhang , Jie Wei , Zhikun Xie , Tianshu Lai , Ke Chen

The temperature and magnetic field dependence of lattice and carrier excitations in MnSi is studied in detail using inelastic light scattering. The pure symmetry components of the electronic response are derived from the polarization…

Strongly Correlated Electrons · Physics 2014-07-23 H. -M. Eiter , P. Jaschke , R. Hackl , A. Bauer , M. Gangl , C. Pfleiderer

First-principles prediction of thermal conductivity and radiative properties is crucial. However, computing phonon scattering, especially for four-phonon scattering, could be prohibitively expensive, and the thermal conductivity even for…

Materials Science · Physics 2023-11-23 Ziqi Guo , Zherui Han , Dudong Feng , Guang Lin , Xiulin Ruan

The subject of thermal transport at the mesoscopic scale and in low-dimensional systems is interesting for both fundamental research and practical applications. As the first example of truly two-dimensional materials, graphene has…

Materials Science · Physics 2014-06-10 Yong Xu , Zuanyi Li , Wenhui Duan

In this work, a Landauer approach enabled by the Frequency Domain Perfectly Matched Layer Method (FDPML) is used to study phonon transport in a series of large 2D domains with randomly embedded nanoparticles over a wide range of…

Mesoscale and Nanoscale Physics · Physics 2024-06-19 Ongira Chowdhury , Joseph P. Feser

Strong electron-phonon interaction which limits electronic mobility of semiconductors can also have significant effects on phonon frequencies. The latter is the key to the use of Raman spectroscopy for nondestructive characterization of…

The ability to minimize the thermal conductivity of dielectrics with minimal structural intervention that could affect electrical properties is an important capability for engineering thermoelectric efficiency in low-cost materials such as…

This study presents the first-principles phonon calculations to understand the experimental thermal expansion ($\alpha(T)$) and lattice thermal conductivity ($\kappa_{L}$) of CoSi at high temperature region. Phonon dispersion is computed…

Materials Science · Physics 2022-05-25 Shamim Sk , Sudhir K. Pandey

Low dimensional systems, nanowires, in particular, have exhibited excellent optical and electronic properties. Understanding the thermal properties in semiconductor nanowires is very important for their applications in their electronic…

We report high pressure Raman experiments of Black phosphorus up to 24 GPa. The line widths of first order Raman modes A$^1_g$, B$_{2g}$ and A$^2_g$ of the orthorhombic phase show a minimum at 1.1 GPa. Our first-principles density…

Strongly Correlated Electrons · Physics 2017-09-20 Satyendra Nath Gupta , Anjali Singh , Koushik Pal , Biswanath Chakraborti , D. V. S. Muthu , U V Waghmare , A. K. Sood

The Wiedemann-Franz (WF) law, relating the electronic thermal conductivity ($\kappa_{\rm e}$) to the electrical conductivity, is vital in numerous applications such as in the design of thermoelectric materials and in the experimental…

Materials Science · Physics 2025-11-13 Luyao Zhong , Xin Jin , Mingquan He , Rui Wang , Xiaoyuan Zhou , Tianqi Deng , Xiaolong Yang

Polarized Raman scattering spectra of superconducting K$_x$Fe$_{2-y}$Se$_2$ and nonsuperconducting K$_{0.8}$Fe$_{1.8}$Co$_{0.2}$Se$_2$ single crystals were measured in a temperature range from 10 K up to 300 K. Two Raman active modes from…

Materials Science · Physics 2016-09-20 M. Opačić , N. Lazarević , M. Šćepanović , Hyejin Ryu , Hechang Lei , C. Petrovic , Z. V. Popović

We present a novel high resolution contactless technique for thermal conductivity determination and thermal field mapping based on creating a thermal distribution of phonons using a heating laser, while a second laser probes the local…

We study the thermal transport properties of three CaF$_{2}$ polymorphs up to a pressure of 30 GPa using first-principle calculations and an interatomic potential based on machine learning. The lattice thermal conductivity $\kappa$ is…

Materials Science · Physics 2022-01-02 Somayeh Faraji , S. Mehdi Vaez Allaei , Maximilian Amsler
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