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Fluorite oxides are attractive ionic compounds for a range of applications with critical thermal management requirements. In view of recent reports alluding to anisotropic thermal conductivity in this face-centered cubic crystalline…

Materials Science · Physics 2023-06-07 Saqeeb Adnan , Miaomiao Jin , Matthew S Bryan , Michael E Manley , David H. Hurley , Marat Khafizov

To efficiently capture the energy of the nuclear bond, advanced nuclear reactor concepts seek solid fuels that must withstand unprecedented temperature and radiation extremes. In these advanced fuels, thermal energy transport under…

The impact of lattice type, period, porosity and thickness of two-dimensional silicon phononic crystals on the reduction of thermal conductance by coherent modification of phonon dispersion is investigated using the theory of elasticity and…

Mesoscale and Nanoscale Physics · Physics 2016-01-20 Roman Anufriev , Masahiro Nomura

Understanding the thermal conductivity of chromium doped V2O3 is crucial for optimizing the design of selectors for memory and neuromorphic devices. We utilized the time-domain thermoreflectance technique to measure the thermal conductivity…

Strongly Correlated Electrons · Physics 2024-09-18 Johannes Mohr , Kiumars Aryana , Md. Rafiqul Islam , Dirk J. Wouters , Rainer Waser , Patrick E. Hopkins , Joyeeta Nag , Daniel Bedau

Fundamental insight into lattice dynamics and phonon transport is critical to the efficient manipulation of heat flow, which is one of the appealing thermophysical problems with enormous practical implications. Phosphorene, a novel…

Materials Science · Physics 2018-01-16 Guangzhao Qin , Ming Hu

The relaxation of a spatially sinusoidal temperature perturbation in a dielectric crystal at a temperature comparable to or higher than the Debye temperature is investigated theoretically. We assume that most phonons contributing to the…

Materials Science · Physics 2011-12-12 A. A. Maznev , Jeremy A. Johnson , Keith A. Nelson

Understanding thermal transport in 2D materials and especially in graphene is a key challenge for the design of heat management and energy conversion devices. The high sensitivity of measured transport properties to structural defects,…

Materials Science · Physics 2020-06-24 G. Bouzerar , S. Thébaud , S. Pecorario , Ch. Adessi

Tuning thermal transport in nanostructured materials is a powerful approach to develop high-efficiency thermoelectric materials. Using a recently developed approach based on the phonon mean free path dependent Boltzmann transport equation,…

Mesoscale and Nanoscale Physics · Physics 2015-06-22 Giuseppe Romano , Jeffrey C. Grossman

Two-dimensional materials have unusual phonon structures due to the presence of flexural (out-of-plane) modes. Although molecular dynamics simulations have been extensively used to study heat transport in such materials, conventional…

Mesoscale and Nanoscale Physics · Physics 2017-06-27 Zheyong Fan , Luiz Felipe C. Pereira , Petri Hirvonen , Mikko M. Ervasti , Ken R. Elder , Davide Donadio , Tapio Ala-Nissila , Ari Harju

Recently, there have been increasing interests in phonon thermal transport in low dimensional materials, due to the crucial importance for dissipating and managing heat in micro and nano electronic devices. Significant progresses have been…

Mesoscale and Nanoscale Physics · Physics 2017-01-12 Xiangfan Xu , Jie Chen , Baowen Li

Problems of heat transport are ubiquitous to various technologies such as power generation, cooling, electronics, and thermoelectrics. In this paper we advocate for the application of the quantum self-consistent reservoir method, which is…

Mesoscale and Nanoscale Physics · Physics 2019-01-30 Roya Moghaddasi Fereidani , Dvira Segal

The thermoelectric transport coefficients of electrons in two recently emerged transition metal dichalcogenides(TMD), MoS2 and WSe2, are calculated by solving Boltzmann Transport equation and coupled electrical and thermal current equations…

Materials Science · Physics 2015-10-28 Krishnendu Ghosh , Uttam Singisetti

We calculate the phonon thermal conductivity of various moir\'e bilayer systems using a continuum approach and the semiclassical transport theory. When the twist angle is close to 0, we observe a significant reduction of thermal…

Mesoscale and Nanoscale Physics · Physics 2025-03-11 Lukas P. A. Krisna , Takuto Kawakami , Mikito Koshino

We study heat dissipation from a (10,10) CNT to a SiO2 substrate using equilibrium and non-equilibrium classical molecular dynamics. The CNT-substrate thermal boundary conductance (TBC) is computed both from the relaxation time of the…

Mesoscale and Nanoscale Physics · Physics 2010-11-22 Zhun-Yong Ong , Eric Pop

Metallic transition-metal nitrides (TMNs) are promising conductive ceramics for many applications, whose thermal transport is of great importance in device design. It is found metallic TiN and HfN hold anomalous thermal transport behaviors…

Materials Science · Physics 2020-06-30 Shouhang Li , Ao Wang , Yue Hu , Xiaokun Gu , Zhen Tong , Hua Bao

Thermal transport in single layer molybdenum disulfide (MoS2) is critical to advancing its applications. In this paper, we use molecular dynamics (MD) simulations with first-principles force constants to study the isotope effect on the…

Materials Science · Physics 2015-10-06 Xufei Wu , Nuo Yang , Tengfei Luo

We present experimental measurements of the thermal boundary conductance (TBC) from $77 - 500$ K across isolated heteroepitaxially grown ZnO films on GaN substrates. These data provide an assessment of the assumptions that drive the phonon…

Understanding the impact of lattice imperfections on nanoscale thermal transport is crucial for diverse applications ranging from thermal management to energy conversion. Grain boundaries (GBs) are ubiquitous defects in polycrystalline…

Thermal management is extremely important for designing high-performance devices. The lattice thermal conductivity of materials is strongly dependent on the structural defects at different length scales, particularly point defects like…

Materials Science · Physics 2021-02-24 Yandong Sun , Yanguang Zhou , Ming Hu , G. Jeffrey Snyder , Ben Xu , Wei Liu

For conventional materials, the thermal conductivity of thin film is usually suppressed when the thickness decreases due to phonon-boundary scattering. However, this is not necessarily true for the van der Waals solids if the thickness is…

Materials Science · Physics 2016-03-01 Xiaokun Gu , Baowen Li , Ronggui Yang