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Graphene is one of the stiffest known materials, with a Young's modulus of 1 TPa, making it an ideal candidate for use as a reinforcement in high-performance composites. However, being a one-atom thick crystalline material, graphene poses…

Materials Science · Physics 2010-07-13 L. Gong , I. A. Kinloch , R. J. Young , I. Riaz , R. Jalil , K. S. Novoselov

Here we present an overview of recent fundamental studies on the nature of the interaction between individual metal atoms and metal clusters and the conjugated surfaces of graphene and carbon nanotube with a particular focus on the…

Materials Science · Physics 2014-09-19 Santanu Sarkar , Robert Cort Haddon

Two-dimensional (2D) materials display nanoscale dynamic ripples that significantly impact their properties. Defects within the crystal lattice are the elementary building blocks to tailor the material's morphology. While some studies have…

Materials Science · Physics 2025-03-11 Fabian L. Thiemann , Camille Scalliet , Erich A. Müller , Angelos Michaelides

A simple model for the "diamond graphitization" type of phase transition is proposed, leading to a good agreement with the experimental data. The phase transition temperature dependence on the external pressure is found. A new phenomenon in…

Materials Science · Physics 2012-08-09 V. N. Strekalov

We study the superconducting phase transition, both in a graphene bilayer and in graphite. For that purpose we derive the mean-field effective potential for a stack of graphene layers presenting hopping between adjacent sheets. For…

Superconductivity · Physics 2020-10-05 Lizardo H. C. M. Nunes , E. C. Marino , A. L. Mota

We report experimentally and theoretically the behavior of freestanding graphene subject to bombardment of energetic ions, investigating the ability of large-scale patterning of freestanding graphene with nanometer sized features by focused…

Mesoscale and Nanoscale Physics · Physics 2016-05-04 Jakob Buchheim , Roman M. Wyss , Ivan Shorubalko , Hyung Gyu Park

Armchair graphene nanoribbons, when forming a superlattice, can be classified in different topological phases, with or without edge states. By means of tight-binding and classical molecular dynamics (MD) simulations, we studied the…

Mesoscale and Nanoscale Physics · Physics 2022-04-06 E. Flores , Jose D. Mella , E. Aparicio , R. I. Gonzalez , C. Parra , E. M. Bringa , F. Munoz

The structural, dynamical, and thermodynamical properties of diamond, graphite and layered derivatives (graphene, rhombohedral graphite) are computed using a combination of density-functional theory (DFT) total-energy calculations and…

Materials Science · Physics 2009-11-10 Nicolas Mounet , Nicola Marzari

A series of measurements using a technique called electrostatic-manipulation scanning tunneling microscopy (EM-STM) were performed on a highly-oriented pyrolytic graphite surface. The electrostatic interaction between the STM tip and the…

Mesoscale and Nanoscale Physics · Physics 2015-06-23 P. Xu , Y. Yang , D. Qi , S. D. Barber , J. K. Schoelz , M. L. Ackerman , L. Bellaiche , P. M. Thibado

The degree of laser-induced graphitisation from a sp3-bonded to a sp2-bonded carbon fraction in a single crystal chemical vapour deposited (CVD) diamond under a varying fluence of an ultrashort pulsed laser (30 fs, 800 nm, 1 kHz)…

Chemical Physics · Physics 2022-03-30 Bakhtiar Ali , Han Xu , Dashavir Chetty , Robert T. Sang , Igor V. Litvinyuk , Maksym Rybachuk

We present the electrical transport characteristics of a batch of nano-crystalline diamond films of varying nitrogen concentrations and explain the conduction mechanism by the disordered quasi-superlattice model applied to semiconductor…

Mesoscale and Nanoscale Physics · Physics 2015-06-05 George Chimowa , Dimitry Churochkin , Somnath Bhattacharyya

We investigate fracture and fragmentation of solids due to impact at low energies using a two-dimensional dynamical model of granular solids. Simulating collisions of two solid discs we show that, depending on the initial energy, the…

Statistical Mechanics · Physics 2009-10-31 Ferenc Kun , Hans J. Herrmann

We investigate the impact induced damage and fracture of a bar shaped specimen of heterogeneous materials focusing on how the system approaches perforation as the impact energy is gradually increased. A simple model is constructed which…

Disordered Systems and Neural Networks · Physics 2020-10-22 Attia Batool , Gergő Pál , Ferenc Kun

The $\pi$-electronic structure of graphene in the presence of a modulated electric potential is investigated by the tight-binding model. The low-energy electronic properties are strongly affected by the period and field strength. Such a…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 J. H. Ho , Y. H. Chiu , S. J. Tsai , M. F. Lin

We report the mechanical properties of cubic boron nitride (c-BN) and diamond under the combined impact of dynamical pressure and temperature, calculated using ab initio molecular dynamics. Our study revealed a pronounced sensitivity of the…

Materials Science · Physics 2023-12-13 Srihari M. Kastuar , Zhong-Li Liu , Sina Najmaei , Chinedu E. Ekuma

We explore quantum-thermodynamic effects in a phosphorous (P)-doped graphene monolayer subjected to biaxial tensile strain. Introducing substitutional P atoms in the graphene lattice generates a tunable spin magnetic moment controlled by…

Mesoscale and Nanoscale Physics · Physics 2024-11-21 Natalia Cortés , J. Hernández-Tecorralco , L. Meza-Montes , R. de Coss , Patricio Vargas

We report measurements of the specific heat, Hall effect, upper critical field and resistivity on bulk, B-doped diamond prepared by reacting amorphous B and graphite under high-pressure/high-temperature conditions. These experiments…

Superconductivity · Physics 2009-11-10 V. A. Sidorov , E. A. Ekimov , S. M. Stishov , E. D. Bauer , J. D. Thompson

Low-energy ion beam modification was proposed to create graphene on the top of the insulated diamond-like carbon films. In such low-temperature fabrication process the surface of the amorphous carbon could crystallize to graphene as a…

Materials Science · Physics 2015-05-27 Savcho Tinchev

We use molecular simulation to construct equilibrium phase diagrams for two recently introduced model materials with isotropic, soft-repulsive pair interactions designed to favor diamond and simple cubic lattice ground states, respectively,…

Materials Science · Physics 2013-10-15 Avni Jain , Jeffrey R. Errington , Thomas M. Truskett

The application of in-plane magnetic fields to Josephson junctions enables fundamental exploration of quantum phenomena, including Zeeman-driven 0-$\pi$ transitions and planar topological superconductivity. However, intrinsic orbital…

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