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We investigate the energy relaxation of hot carriers produced by photoexcitation of graphene through coupling to both intrinsic and remote (substrate) surface polar phonons using the Boltzmann equation approach. We find that the energy…

Mesoscale and Nanoscale Physics · Physics 2012-08-15 Tony Low , Vasili Perebeinos , Raseong Kim , Marcus Freitag , Phaedon Avouris

There has been great interest in two-dimensional materials, beyond graphene, for both fundamental sciences and technological applications. Silicene, a silicon counterpart of graphene, has been shown to possess some better electronic…

Materials Science · Physics 2015-01-13 Xiaokun Gu , Ronggui Yang

One of the factors limiting electron mobility in supported graphene is remote phonon scattering. We formulate the theory of the coupling between graphene plasmon and substrate surface polar phonon (SPP) modes, and find that it leads to the…

Mesoscale and Nanoscale Physics · Physics 2015-06-05 Zhun-Yong Ong , Massimo V. Fischetti

The design of graphene-based composite with high thermal conductivity requires a comprehensive understanding of phonon coupling in graphene. We extended the two-temperature model to coupled groups of phonon. The study give new physical…

Mesoscale and Nanoscale Physics · Physics 2017-10-11 Meng An , Qichen Song , Xiaoxiang Yu , Han Meng , Dengke Ma , Ruiyang Li , Zelin Jin , Baoling Huang , Nuo Yang

We present a study of transport in graphene devices on polar insulating substrates using a tight-binding model. The mobility is computed using a multiband Boltzmann treatment. We provide the scaling of the surface polar phonon contribution…

Mesoscale and Nanoscale Physics · Physics 2009-10-27 Vasili Perebeinos , Phaedon Avouris

We report our theoretical calculations on the temperature and energy dependent electrical conductivity of gapped graphene within the framework of Boltzmann transport formalism. Since screening effects have known to be of vital importance in…

Mesoscale and Nanoscale Physics · Physics 2015-04-07 Digish K Patel , A C Sharma , S S Z Ashraf

Thermal conductivity measurements over variable lengths on nanostructures such as nanowires provide important information about the mean free paths (MFPs) of the phonons responsible for heat conduction. However, nearly all of these…

Mesoscale and Nanoscale Physics · Physics 2015-02-23 Hang Zhang , Chengyun Hua , Ding Ding , Austin J. Minnich

The effect of the SiO$_2$ substrate on a graphene film is investigated using realistic but computationally convenient energy-optimized models of the substrate supporting a layer of graphene. The electronic bands are calculated using…

Mesoscale and Nanoscale Physics · Physics 2007-11-06 M. W. C. Dharma-wardana

Thermal conduction was explored and discussed through a combined theoretical and simulation approach in this work. The thermal conductivity k of polycrystalline graphene was calculated by molecular dynamics simulations based on a hexagonal…

Materials Science · Physics 2014-06-05 Yanlei Wang , Zhigong Song , Zhiping Xu

The temperature ($\it T$) dependence of electrical resistivity in graphene has been experimentally investigated between 10 and 400 K for samples prepared on various substrates; HfO$_2$, SiO$_2$ and h-BN. The resistivity of graphene shows a…

Mesoscale and Nanoscale Physics · Physics 2019-07-29 Y. G. You , J. H. Ahn , B. H. Park , Y. Kwon , E. E. B. Campbell , S. H. Jhang

The thermal properties of graphene-based materials are theoretically investigated. The fourth-nearest neighbor force constant method for phonon properties is used in conjunction with both the Landauer ballistic and the non-equilibrium…

Materials Science · Physics 2012-02-10 Hossein Karamitaheri , Neophytos Neophytou , Mahdi Pourfath , Hans Kosina

Phonon transport of recently-fabricated $\mathrm{Na_2He}$ at high pressure is investigated from a combination of first-principles calculations and the linearized phonon Boltzmann equation within the single-mode relaxation time approximation…

Materials Science · Physics 2017-05-24 San-Dong Guo , Ai-Xia Zhang

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…

Mesoscale and Nanoscale Physics · Physics 2021-04-12 Zhen Tong , Alessandro Pecchia , ChiYung Yam , Traian Dumitricǎ , Thomas Frauenheim

Two-dimensional (2D) materials represented by graphene stand out in future electrical industry and have been widely studied. As a commonly existing factor in electronic devices, the electric field has been extensively utilized to modulate…

Computational Physics · Physics 2022-08-17 E Zhou , Donghai Wei , Jing Wu , Guangzhao Qin , Ming Hu

Heat transport by acoustic phonons in 2D materials is fundamentally different from that in 3D crystals because the out-of-plane phonons propagate in a unique way that strongly depends on tension and bending rigidity. Since in-plane and…

Mesoscale and Nanoscale Physics · Physics 2022-04-15 H. Liu , M. Lee , M. Šiškins , H. S. J. van der Zant , P. G. Steeneken , G. J. Verbiest

Inelastic phonon scattering in graphene field-effect transistors (FETs) is studied by numerically solving the Boltzmann transport equation in three dimensional real and phase spaces (x, kx, ky). A kink behavior due to ambipolar transport…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 Jyotsna Chauhan , Jing Guo

The Joule heating effect on graphene electronic properties is investigated by using full-band Monte Carlo electron dynamics and three-dimensional heat transfer simulations self-consistently. A number of technologically important substrate…

Mesoscale and Nanoscale Physics · Physics 2011-11-01 X. Li , B. D. Kong , J. M. Zavada , K. W. Kim

The enhancement of thermoelectric figure of merit ZT requires to either increase the power factor or reduce the phonon conductance, or even both. In graphene, the high phonon thermal conductivity is the main factor limiting the…

Mesoscale and Nanoscale Physics · Physics 2016-09-19 Van-Truong Tran , Jérôme Saint-Martin , Philippe Dollfus , Sebastian Volz

Using the semi-classical Boltzmann theory, we calculate the conductivity as function of the carrier density. As usually, we include the scattering from charged impurities, but conclude that the estimated impurity density is too low in order…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 T. Stauber , N. M. R. Peres , F. Guinea

We have implemented a generic method, based on the 2n+1 theorem within density functional perturbation theory, to calculate the anharmonic scattering coefficients among three phonons with arbitrary wavevectors. The method is used to study…

Materials Science · Physics 2014-06-24 Lorenzo Paulatto , Francesco Mauri , Michele Lazzeri