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We investigate the effect of strain and isotopic disorder on thermal transport in suspended graphene by equilibrium molecular dynamics simulations. We show that the thermal conductivity of unstrained graphene, calculated from the…

材料科学 · 物理学 2013-08-08 Luiz Felipe C. Pereira , Davide Donadio

We study the effect of the electron-phonon interaction on the finite frequency dependent electronic thermal conductivity of two dimensional graphene. We calculate it for various acoustic phonons present in graphene and characterized by…

强关联电子 · 物理学 2017-04-07 Pankaj Bhalla

In this work, we present a comprehensive investigation of graphene's thermal conductivity using first-principles density functional perturbation theory calculations, with a focus on the phonon and lattice vibrational properties underlying…

材料科学 · 物理学 2024-12-25 Archishman Gupta , Ankit Arora

Graphene exhibits extraordinary electronic and mechanical properties, and extremely high thermal conductivity. Being a very stable atomically thick membrane that can be suspended between two leads, graphene provides a perfect test platform…

The phonon thermal transport properties of twisted bi-layer graphene are investigated using lattice dynamics and the Boltzmann transport equation. The thermal conductivities of 13.2 and 21.8 twisted configurations are 56% and 36% lower than…

介观与纳米尺度物理 · 物理学 2023-11-07 Shahid Ahmed , Shadab Alam , Ankit Jain

The mechanical properties of two-dimensional materials are important for a wide range of applications including composite and van der Waals-materials, flexible electronics and superconductivity. Several aspects are highly debated in the…

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…

材料科学 · 物理学 2022-01-02 Somayeh Faraji , S. Mehdi Vaez Allaei , Maximilian Amsler

Non-equilibrium transport and phonon branch-resolved size effects in single-layer graphene materials are studied under a multi-temperature kinetic model, which is developed for capturing the branch-dependent electron-phonon coupling.…

介观与纳米尺度物理 · 物理学 2025-10-07 Chuang Zhang , Houssem Rezgui , Meng Lian , Hong Liang

Properties of phonons - quanta of the crystal lattice vibrations - in graphene have attracted strong attention of the physics and engineering communities. Acoustic phonons are the main heat carriers in graphene near room temperature while…

介观与纳米尺度物理 · 物理学 2015-06-04 Denis L. Nika , Alexander A. Balandin

We reveal that phononic thermal transport in graphene is not immune to grain boundaries (GBs) aligned along the direction of the temperature gradient. Non-equilibrium molecular dynamics simulations uncover a large reduction in the phononic…

介观与纳米尺度物理 · 物理学 2021-04-12 Zhen Tong , Alessandro Pecchia , ChiYung Yam , Traian Dumitricǎ , Thomas Frauenheim

The authors proposed a simple model for the lattice thermal conductivity of graphene in the framework of Klemens approximation. The Gruneisen parameters were introduced separately for the longitudinal and transverse phonon branches through…

材料科学 · 物理学 2015-05-13 D. L. Nika , S. Ghosh , E. P. Pokatilov , A. A. Balandin

The lattice thermal conductivity of graphene is evaluated using a microscopic model that takes into account the lattice's discrete nature and the phonon dispersion relation within the Brillouin zone. The Boltzmann transport equation is…

软凝聚态物质 · 物理学 2024-01-18 J. Chen , Y. Liu

Phonon size effects induce ballistic transport in nanomaterials, challenging Fourier's law. Nondiffusive heat transport is captured by the Peierls-Boltzmann transport equation (BTE), commonly solved under the relaxation time approximation…

介观与纳米尺度物理 · 物理学 2020-03-10 Giuseppe Romano

We present systematic thermal conductivity measurements of suspended thin graphite ribbons, 234-527 nm thick, using a four-probe 3-omega method. Unlike recent reports of phonon hydrodynamics and exceptionally high thermal conductivity in…

介观与纳米尺度物理 · 物理学 2025-09-16 Wonjae Jeon , Yu Pei , Xun Li , Lucas Lindsay , Sangyeop Lee , Renkun Chen

Using first-principles modeling, we investigate how phonon transport evolves in layered/van der Waals materials when going from 3D to 2D, or vice versa, by gradually pulling apart the atomic layers in graphite to form graphene. Focus is…

介观与纳米尺度物理 · 物理学 2021-08-04 Patrick Strongman , Jesse Maassen

Declining the lattice thermal conductivity in graphene is essential for its thermoelectric applications. In high electron density systems, scatterings of phonons by electrons are no less than the phonon scatterings by other phonons. With…

材料科学 · 物理学 2019-08-08 Ajit Jena , Wu Li

Understanding the mechanisms of thermal conduction in graphene is a long-lasting research topic, due to its high thermal conductivity. Peierls-Boltzmann transport equation (PBTE) based studies have revealed many unique phonon transport…

材料科学 · 物理学 2019-08-14 Xiaokun Gu , Zheyong Fan , Hua Bao , C. Y. Zhao

The low-temperature thermal conductivity in polycrystalline graphene is theoretically studied. The contributions from three branches of acoustic phonons are calculated by taking into account scattering on sample borders, point defects and…

材料科学 · 物理学 2015-06-05 D. V. Kolesnikov , V. A. Osipov

The thermal conductivity of monolayer graphene is an outstanding challenge with no consensus reached on its exact value and length convergence so far. We consider four-phonon scattering, phonon renormalization, and an exact solution to…

介观与纳米尺度物理 · 物理学 2023-10-02 Zherui Han , 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…

材料科学 · 物理学 2014-06-10 Yong Xu , Zuanyi Li , Wenhui Duan
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