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In this work, we study the thermal energy transport properties of twin graphene, which has been introduced recently as a new two-dimensional carbon nano structure. The thermal conductivity is investigated using non-equilibrium molecular…

Computational Physics · Physics 2020-12-30 Fatemeh Rezaee , Farrokh Yousefi , Farhad Khoeini

We study the rectification of a two-dimensional thermal gas in a channel of asymmetric dissipative walls. For an ensemble of smooth Lennard-Jones particles, our numerical simulations reveal a non-monotonic dependence of the flux on the…

Soft Condensed Matter · Physics 2017-09-07 S. Solorzano , N. A. M. Araujo , H. J. Herrmann

In this work we conduct an extensive study of the asymmetric heat flow, i.e. thermal rectification, present in the two-segment Frenkel Kontorova model with both nearest-neighbor (NN) and next-nearest-neighbor (NNN) interactions. We have…

Statistical Mechanics · Physics 2024-11-18 M. Romero-Bastida , A. Poceros Varela

Graphene nanosheets display large hydrodynamic slip lengths in most solvents, and because of this, adopt a stable orientation in a shear flow instead of rotating when thermal fluctuations are negligible [Kamal et al., Nature Comm.,…

Computational Physics · Physics 2024-12-13 Simon Gravelle , Catherine Kamal , Lorenzo Botto

Large scale atomistic simulations using the reactive force field approach (ReaxFF) are implemented to investigate the thermomechanical properties of fluorinated graphene (FG). A new set of parameters for the reactive force field potential…

Mesoscale and Nanoscale Physics · Physics 2015-06-15 S. K. Singh , S. Goverapet Srinivasan , M. Neek-Amal , S. Costamagna , Adri C. T. van Duin , F. M. Peeters

Thermal properties of graphene display peculiar characteristics associated to the two-dimensional nature of this crystalline membrane. These properties can be changed and tuned in the presence of applied stresses, both tensile and…

Materials Science · Physics 2018-06-07 Carlos P. Herrero , Rafael Ramirez

Radiative thermal diodes based on two-element structures rectify heat flows thanks to a temperature dependence of material optical properties. The heat transport asymmetry through these systems, however, remains weak without a significant…

Mesoscale and Nanoscale Physics · Physics 2021-07-15 Ivan Latella , Philippe Ben-Abdallah , Moladad Nikbakht

Heat rectifiers would facilitate energy management operations such as cooling, or energy harvesting, but devices of practical interest are still missing. Understanding heat rectification at a fundamental level is key to help us find or…

Statistical Mechanics · Physics 2023-07-05 Javier Navarro , Juan Gonzalo Muga , Marisa Pons

Catalyst-free vertically aligned graphene nanoflakes possessing a large amount of high density edge planes were functionalized using nitrogen species in a low energy N+ ion bombardment process to achieve pyridinic, cyanide and nitrogen…

Materials Science · Physics 2012-05-15 Ajay Kumar , Abhijit Ganguly , Pagona Papakonstantinou

As an analogue to electrical diode, a radiative thermal diode allows radiation to transfer more efficiently in one direction than in the opposite direction by operating in a contactless mode. In this study, we demonstrated that, within the…

Optics · Physics 2023-09-11 Ming-Jian He , Xue Guo , Hong Qi , Zhi-Heng Zheng , Mauro Antezza , He-Ping Tan

The thermodynamic and kinetic properties of hydrogen adatoms on graphene are important to the materials and devices based on hydrogenated graphene. Hydrogen dimers on graphene with coverages varying from 0.040 to 0.111 ML (1.0 ML $=…

Materials Science · Physics 2011-11-10 Liang Feng Huang , Mei Yan Ni , Yong Gang li , Wang Huai Zhou , Xiao Hong Zheng , Ling Ju Guo , Zhi Zeng

We demonstrate the possibility to efficiently split the near-field heat flux exchanged between graphene nano-disks by tuning their doping. This result paves the way for the developement of an active control of propagation directions for…

We use non-perturbative renormalization group techniques to calculate the momentum dependence of thermal fluctuations of graphene, based on a self-consistent calculation of the momentum dependent elastic constants of a tethered membrane. We…

Soft Condensed Matter · Physics 2010-07-13 F. L. Braghin , N. Hasselmann

In this work using non-equilibrium molecular dynamics simulation we implement a series of simulation under positive and negative temperature gradient in order to investigate the thermal rectification in the graphene C3B junction GCB. The…

Materials Science · Physics 2021-04-07 Leila Kiani , Javad Hasanzadeh , Farrokh Yousefi

Density-functional tight-binding and classical molecular dynamics simulations are used to investigate the structural deformations and melting of planar carbon nano-clusters $C_{N}$ with N=2-55. The minimum energy configurations for…

Materials Science · Physics 2013-04-23 Sandeep Kumar Singh , M. Neek-Amal , F. M. Peeters

Current understanding of thermal rectification asserts that the rectification ratio (R), which measures the relative heat flux between two ends of a nanostructure, is determined by its geometric asymmetry. The higher the asymmetry, the…

Mesoscale and Nanoscale Physics · Physics 2016-03-25 Zhongwei Zhang , Yuanping Chen , Yuee Xie , Shengbai Zhang

Approach-to-equilibrium molecular dynamics simulations have been used to study thermal transport in nanocrystalline graphene sheets. Nanostructured graphene has been created using an iterative process for grain growth from initial seeds…

Materials Science · Physics 2015-11-26 Konstanze R. Hahn , Claudio Melis , Luciano Colombo

We report on the investigation of thermal transport in non-cured silicone composites with graphene fillers of different lateral dimensions. Graphene fillers are comprised of few-layer graphene flakes with lateral sizes in the range from 400…

Diffusion of a graphene flake on a graphene layer is analyzed and a new diffusion mechanism is proposed for the system under consideration. According to this mechanism, rotational transition of the flake from commensurate to incommensurate…

Mesoscale and Nanoscale Physics · Physics 2011-02-22 Irina V. Lebedeva , Andrey A. Knizhnik , Andrey M. Popov , Olga V. Ershova , Yurii E. Lozovik , Boris V. Potapkin

We investigate the near-field radiative heat transfer between a normally and/or laterally shifted nanoparticle and a planar fused silica slab coated with a strip graphene grating. For this study we develop and use a scattering matrix…

Mesoscale and Nanoscale Physics · Physics 2025-02-20 Minggang Luo , Youssef Jeyar , Brahim Guizal , Mauro Antezza