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Using molecular dynamics (MD) with classical interaction potentials we present calculations of thermal conductivity and heat transport in crystals and glasses. Inducing shock waves and heat pulses into the systems we study the spreading of…

Materials Science · Physics 2009-10-31 C. Oligschleger , J. C. Sch"on

Using harmonic and anharmonic force constants extracted from density-functional calculations within a supercell, we have developed a relatively simple but general method to compute thermodynamic and thermal properties of any crystal. First,…

Materials Science · Physics 2015-05-28 Keivan Esfarjani , Gang Chen , Harold T. Stokes

Molecular dynamics simulations play an important role in studying heat transport in complex materials. The lattice thermal conductivity can be computed either using the Green-Kubo formula in equilibrium MD (EMD) simulations or using…

Computational Physics · Physics 2018-05-02 Haikuan Dong , Zheyong Fan , Libin Shi , Ari Harju , Tapio Ala-Nisilla

Dots are ideal systems to study fundamentals on heat transfer at the nanoscale and promising nanoscale heat-engines and thermal devices. Here, we report on the validation of our theoretical model on the thermal conductance of a metallic dot…

Mesoscale and Nanoscale Physics · Physics 2018-06-06 Xanthippi Zianni

Heat conduction phenomena are studied theoretically using computer simulation. The systems are crystal with nonlinear interaction, and fluid of hard-core particles. Quasi-one-dimensional system of the size of $L_x\times L_y\times L_z(L_z\gg…

Statistical Mechanics · Physics 2009-10-31 Takashi Shimada , Teruyoshi Murakami , Satoshi Yukawa , Keiji Saito , Nobuyasu Ito

Utilizing atomistic lattice dynamics and scattering theory, we study thermal transport in nanodevices made of 10 nm thick silicon nanowires, from 10 to 100 nm long, sandwiched between two bulk reservoirs. We find that thermal transport in…

Materials Science · Physics 2013-05-08 Ivan Duchemin , Davide Donadio

The convective heat transfer and flow behavior of graphene-water nanofluids are studied experimentally by focusing on transitional flow. Graphene-water nanofluids with different particle mass fractions (0.025, 0.1 and 0.2%) are produced…

Applied Physics · Physics 2020-09-23 Cayan Demirkir , Hakan Erturk

Understanding transport behavior in nanoconfined environments is critical to many natural and engineering systems, including cementitious materials, yet its molecular-level mechanisms remain poorly understood. Here, molecular dynamics (MD)…

Chemical Physics · Physics 2025-09-30 Weiqiang Chen , Kai Gong

Toward measuring the thermal properties of exfoliated atomically thin materials, we demonstrate simultaneous measurements of the thermal conductivity and specific heat in suspended membranes. We use the 3{\omega} technique applied to…

Materials Science · Physics 2026-04-28 Yiwei Le , Erdong Song , Jason Li , Erik A. Henriksen

Controlling thermal energy transfer at the nanoscale has become critically important in many applications and thermal properties since it often limits device performance. In this work, we study the effects on thermal conductivity arising…

The heat conduction in an open transverse-field Ising chain is studied by using quantization in the Fock space of operators in the weak coupling regimes, i.e. the coupling is much smaller than the transverse field. The non-equilibrium…

Disordered Systems and Neural Networks · Physics 2015-05-20 Ke-Wei Sun , Chen Wang , Qing-Hu Chen

The proper design and synthesis of molecular junctions for the purpose of establishing percolative networks of conductive nanoparticles represent an opportunity to develop more efficient thermally-conductive nanocomposites, with several…

Recent advances in our understanding of thermal transport in nanocrystalline systems are responsible for the integration of new technologies into advanced energy systems, including thermoelectric refrigeration systems and renewable energy…

Mesoscale and Nanoscale Physics · Physics 2019-08-12 Brian F. Donovan , Ronald J. Warzoha , R. Bharath Venkatesh , Nicholas T. Vu , Jay Wallen , Daeyeon Lee

New results obtained for thermal conduction in 2D Yukawa systems. The results of numerical study of heat transfer processes for quasi equilibrium systems with parameters close to conditions in laboratory experiments with dusty plasma are…

Plasma Physics · Physics 2015-06-03 Yu. V. Khrustalyov , O. S. Vaulina

Heating of trapped ion clouds by interactions with free electrons crossing the trapping potential was observed. A model describing such process was proposed and discussed. The presented approach predicts two effects: pushing and heating of…

Plasma Physics · Physics 2018-11-14 Łukasz Kłosowski , Mariusz Piwiński

Using equilibrium and nonequilibrium molecular dynamics simulations, we determine the Kapitza resistance (or thermal contact resistance) at a model liquid solid interface. The Kapitza resistance (or the associated Kapitza length) can reach…

Materials Science · Physics 2009-11-07 Jean-Louis Barrat , François Chiaruttini

Electrons in operating microelectronic semiconductor devices are accelerated by locally varying strong electric field to acquire effective electron temperatures nonuniformly distributing in nanoscales and largely exceeding the temperature…

Mesoscale and Nanoscale Physics · Physics 2020-01-08 Le Yang , Ruijie Qian , Zhenghua An , Susumu Komiyama , Wei Lu

So far transport properties of nanoscale contacts have been mostly studied within the static scattering approach. The electron dynamics and the transient behavior of current flow, however, remain poorly understood. We present a numerical…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Na Sai , Neil Bushong , Ryan Hatcher , Massimiliano Di Ventra

Diffusion of ions due to temperature gradients (known as thermal diffusion) in charged nanochannels is of interest in several engineering fields, including energy recovery and environmental protection. This paper presents a fundamental…

Chemical Physics · Physics 2022-12-06 Wei Qiang Chen , Majid Sedighi , Andrey P Jivkov

We report an experimental and theoretical analysis of the energy exchanged between two conductors kept at different temperature and coupled by the electric thermal noise. Experimentally we determine, as functions of the temperature…

Statistical Mechanics · Physics 2015-06-12 Sergio Ciliberto , Alberto Imparato , Antoine Naert , Marius Tanase
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