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The concept of the diode is usually applied to electronic and thermal devices but very rarely for mechanical ones. A recently proposed fracture rectification effect in polymer-based structures with triangular voids defects has motivated us…

Materials Science · Physics 2022-06-22 Levi C. Felix , Douglas S. Galvao

Nano-indentation of circular graphene flakes are studied by using Molecular Dynamics simulation. We show that the theory of continuum elasticity based on nonlinear F\"{o}pple-Hencky equations is applicable on a circular suspended graphene…

Materials Science · Physics 2011-12-07 Mehdi Neek-Amal , Reza Asgari

Self-heating is a severe problem for high-power microelectronic devices. Graphene and few-layer graphene have attracted tremendous attention for heat removal thanks to their extraordinarily high in-plane thermal conductivity. However, this…

Thermal fluctuations of single layer hydrogenated graphene (graphane) are investigated using large scale atomistic simulations. By analyzing the mean square value of the height fluctuations $<h^2>$ and the height-height correlation function…

Materials Science · Physics 2015-06-05 S. Costamagna , M. Neek-Amal , J. H. Los , F. M. Peeters

We directly image hot spot formation in functioning mono- and bilayer graphene field effect transistors (GFETs) using infrared thermal microscopy. Correlating with an electrical-thermal transport model provides insight into carrier…

Mesoscale and Nanoscale Physics · Physics 2010-12-30 Myung-Ho Bae , Zhun-Yong Ong , David Estrada , Eric Pop

Inspired by some recent molecular dynamics (MD) simulations and experiments on suspended graphene nanoribbons, we study a simplified model where the atoms are disposed in a rectangular lattice coupled by nearest neighbor interactions which…

Mesoscale and Nanoscale Physics · Physics 2015-10-20 R. Barreto , M. F. Carusela , A. Mancardo Viotti , A. G. Monastra

The thermo-mechanical coupling mechanism of graphene fracture under thermal gradients possesses rich applications whereas is hard to study due to its coupled non-equilibrium nature. We employ non-equilibrium molecular dynamics to study the…

Materials Science · Physics 2023-05-17 Hanfeng Zhai , Jingjie Yeo

In this work, a thermal rectification ratio $\eta$ of 18.5% was observed in partially perforated graphene with the use of Molecular Dynamics (MD) simulations. In all cases studied here, heat preferentially flows from the porous to the…

Materials Science · Physics 2025-04-23 Markos Poulos , Konstantinos Termentzidis

Graphene is of great scientific interest due to a variety of unique properties such as ballistic transport, spin selectivity, the quantum hall effect, and other quantum properties. Nanopatterning and atomic scale modifications of graphene…

Mesoscale and Nanoscale Physics · Physics 2023-07-13 Ondrej Dyck , Sinchul Yeom , Sarah Dillender , Andrew R. Lupini , Mina Yoon , Stephen Jesse

Proceeding from the model of a two-dimensional elastic continuum, we describe the characteristic features of thermal expansion of graphene using an approach that goes beyond the quasi-harmonic approximation. The negative value of the…

Mesoscale and Nanoscale Physics · Physics 2018-01-24 Viktor N. Bondarev , Vadym Adamyan , Volodymyr V. Zavalniuk

Nonlinear electrical properties of graphene-based three-terminal nanojunctions are presented. Intrinsic rectification of voltage is observed up to room temperature. The sign and the efficiency of the rectification can be tuned by a gate.…

Mesoscale and Nanoscale Physics · Physics 2010-07-23 A. Jacobsen , I. Shorubalko , L. Maag , U. Sennhauser , K. Ensslin

Knowledge of and control over the curvature of ripples in freestanding graphene are desirable for fabricating and designing flexible electronic devices, and recent progress in these pursuits has been achieved using several advanced…

Mesoscale and Nanoscale Physics · Physics 2015-06-23 M. Neek-Amal , P. Xu , J. K. Schoelz , M. L. Ackerman , S. D. Barber , P. M. Thibado , A. Sadeghi , F. M. Peeters

We present a theoretical investigation of electron heat current in asymmetrical length armchair graphene nanoribbon (AGNR) heterostructures with vacancies, focusing on the topological states (TSs). In particular, we examine the 9-7-9 AGNR…

Mesoscale and Nanoscale Physics · Physics 2023-10-04 David M T Kuo

The effect of graphene flakes on the strength of Ni-graphene composites is investigated using molecular dynamics simulation. Rather than introducing flakes as flat structures into the Ni matrix, as it is common in available studies, we…

Materials Science · Physics 2021-08-05 Vardan Hoviki Vardanyan , Herbert M. Urbassek

We report a molecular dynamics study on the tensile mechanics of graphene as gradually rotating the tensile direction from armchair to zigzag direction, covering the complete range of chiral directions which has never been explored so far.…

Materials Science · Physics 2013-01-30 Young In Jhon , Myung S. Jhon

We report on heat conduction properties of thermal interface materials with self-aligning "magnetic grapheme" fillers. Graphene enhanced nano-composites were synthesized by an inexpensive and scalable technique based on liquid-phase…

Materials Science · Physics 2015-10-16 J. Renteria , S. Legedza , R. Salgado , M. P. Balandin , S. Ramirez , M. Saadah , F. Kargar , A. A. Balandin

In this work we study the asymmetric heat flow, i.e., thermal rectification, of a one-dimensional, mass-graded system consisting of acoupled harmonic oscillator lattice (ballistic spacer) and two diffusive leads attached to the boundaries…

Statistical Mechanics · Physics 2021-03-03 M. Romero-Bastida , Jeanette-Ivonne Amaya-Durán

Thermal properties of graphene monolayers are studied by path-integral molecular dynamics (PIMD) simulations, which take into account the quantization of vibrational modes in the crystalline membrane, and allow one to consider anharmonic…

Materials Science · Physics 2017-09-18 Carlos P. Herrero , Rafael Ramirez

This paper reports on the thermal properties of reduced graphite oxide (RGO) flakes, studied by means of scanning thermal microscopy (SThM). This technique was demonstrated to allow thermal characterization of the flakes with a spatial…

By coupling two nonlinear one dimensional lattices, we demonstrate a thermal diode model that works in a wide range of system parameters. We provide numerical and analytical evidence for the underlying mechanism which allows heat flux in…

Disordered Systems and Neural Networks · Physics 2009-11-10 Baowen Li , Lei Wang , Giulio Casati