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Thermal runaway in lithium-ion batteries is a critical safety concern for the battery industry due to its potential to cause uncontrolled temperature rises and subsequent fires that can engulf the battery pack and its surroundings. Modeling…

Computational Engineering, Finance, and Science · Computer Science 2025-07-15 Saakaar Bhatnagar , Andrew Comerford , Zelu Xu , Simone Reitano , Luigi Scrimieri , Luca Giuliano , Araz Banaeizadeh

We develop a theory of heat transfer induced by thermal charge fluctuations in two-dimensional electron double layers. We consider pristine systems comprised of identical layers, and focus on the regime of sufficiently high temperatures and…

Mesoscale and Nanoscale Physics · Physics 2023-08-21 Dmitry Zverevich , A. V. Andreev , Alex Levchenko

Understanding heat transport in organic semiconductors is of fundamental and practical relevance. Therefore, we study the lattice thermal conductivities of a series of (oligo)acenes, where an increasing number of rings per molecule leads to…

Materials Science · Physics 2024-12-09 Lukas Legenstein , Lukas Reicht , Sandro Wieser , Michele Simoncelli , Egbert Zojer

The reliability and safety of lithium-ion batteries can be affected by overheating issues. Phase change materials like paraffin due to their large heat capacities are among the best solutions for the thermal management of batteries. In this…

Computational Physics · Physics 2017-06-22 Bohayra Mortazavi , Hongliu Yang , Farzad Mohebbi , Gianaurelio Cuniberti , Timon Rabczuk

Accurately capturing and simulating multiscale systems is a formidable challenge, as both spatial and temporal scales can span many orders of magnitude. Rigorous upscaling methods not only ensure efficient computation, but also maintains…

Computational Physics · Physics 2025-04-15 Yinuo Noah Yao , Ilenia Battiato

The ability to control heat transport with electrical signals has been an outstanding challenge due to the lack of efficient electrothermal materials. Previous attempts have mainly concentrated on phase-change and layered materials and…

The microscale thermal transport properties of $\alpha$RDX are believed to be major factors in the initiation process. In this study we present a thorough examination of phonon properties which dominate energy storage and transport in…

Materials Science · Physics 2018-10-04 Francis G. VanGessel , Gaurav Kumar , Daniel C. Elton , Peter W. Chung

We study two thermo-electrochemical models for lithium-ion batteries. The first is based on volume averaging the electrode microstructure whereas the second is based on the pseudo-two-dimensional (P2D) approach which treats the electrode as…

Applied Physics · Physics 2019-07-08 Matthew G. Hennessy , Iain R. Moyles

We report on the temperature dependent electron transport in graphene at different carrier densities $n$. Employing an electrolytic gate, we demonstrate that $n$ can be adjusted up to 4$\times10^{14}$cm$^{-2}$ for both electrons and holes.…

Mesoscale and Nanoscale Physics · Physics 2010-12-14 Dmitri K. Efetov , Philip Kim

A thorough understanding of the microscopic picture of heat conduction in solids is critical to a broad range of applications, from thermal management of microelectronics to more efficient thermoelectric materials. The transport properties…

Materials Science · Physics 2021-02-04 Yujie Quan , Shengying Yue , Bolin Liao

We study ballistic interfacial thermal transport across atomic junctions. Exact expressions for phonon transmission coefficients are derived for thermal transport in one-junction and two-junction chains, and verified by numerical…

Materials Science · Physics 2011-03-02 Lifa Zhang , Pawel Keblinski , Jian-Sheng Wang , Baowen Li

Active thermal management requires advances in thermal switching materials, whose thermal conductivity responds to external stimuli. The electric field, as one of the most convenient and effective stimuli, has shown great potential in…

Materials Science · Physics 2025-11-20 Fanghao Zhang , Guanchun Rui , Yujie Quan , Shantal Adajian , Matthew Delmont , Q. M. Zhang , Bolin Liao

Anharmonic lattice vibrations govern the thermal dynamics in materials and present how the atoms interact and how they conduct heat. An indepth understanding of the microscopic mechanism of phonon anharmonicity in condensed systems is…

Materials Science · Physics 2021-12-30 Bin Wei , Qiyang Sun , Chen Li , Jiawang Hong

Using the atomistic nonequilibrium Green's function, we find that thermal conductance of carbon nanotubes with presence of topological lattice imperfects is remarkably reduced, due to the strong Rayleigh scattering of high-frequency…

Mesoscale and Nanoscale Physics · Physics 2012-03-14 Jian Wang , Liang Li , Jian-Sheng Wang

High performance thermoelectric devices requires materials with low lattice thermal conductivities. Many strategies, such as phonon engineering, have been made to reduce lattice thermal conductivity without simultaneously decrease of the…

Materials Science · Physics 2020-01-07 Xiaoxia Yu , Hezhu Shao , Xueyun Wang , Yingcai Zhu , Daining Fang , Jiawang Hong

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…

Two-dimensional gallium nitride (2D-GaN) has great potential in power electronics and optoelectronics. Heat dissipation is a critical issue for these applications of 2D-GaN. Previous studies showed that higher-order phonon-phonon scattering…

Materials Science · Physics 2024-03-12 Jianshi Sun , Xiangjun Liu , Yucheng Xiong , Yuhang Yao , Xiaolong Yang , Cheng Shao , Shouhang Li

Time-dependent driving of quantum systems has emerged as a powerful tool to engineer exotic phases far from thermal equilibrium, but in the presence of many-body interactions it also leads to runaway heating, so that generic systems are…

Strongly Correlated Electrons · Physics 2023-07-03 Manuel Weber , James K. Freericks

$\beta-Ga_2O_3$ is a promising material candidate for next-generation high power devices even as its low thermal conductivity ($\kappa$) limits utilization due to an inability to sufficiently dissipate heat. Despite its importance, a…

Materials Science · Physics 2024-10-16 Abdulaziz Alkandari , Zherui Han , Ziqi Guo , Thomas Beechem , Xiulin Ruan

We consider phononic heat transport through molecular chains connecting two thermal reservoirs. For relatively short molecules at normal temperatures heat conduction is dominated by the harmonic part of the molecular force-field. We develop…

Chemical Physics · Physics 2009-11-10 Dvira Segal , Abraham Nitzan , Peter Hanggi
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