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We have developed a novel method for crystalline hydrogenation of graphene on the nanoscale. Molecular hydrogen was physisorbed at 5 K onto pristine graphene islands grown on Cu(111) in ultrahigh vacuum. Field emission local to the tip of a…

Mesoscale and Nanoscale Physics · Physics 2017-06-06 S. J. Tjung , S. M. Hollen , G. A. Gambrel , N. M. Santagata , E. Johnston-Halperin , J. A. Gupta

Zigzag graphene nanoribbons patterned on graphane are studied using spin-polarized ab initio calculations. We found that the electronic and magnetic properties of the graphene/graphane superlattice strongly depends on the degree of…

Mesoscale and Nanoscale Physics · Physics 2010-10-19 A. D. Hernandez-Nieves , B. Partoens , F. M. Peeters

Defects change essentially not only electronic but also chemical properties of graphene being centers of its chemical activity. Their functionalization is a way to modify electronic and crystal structure of graphene which may be important…

Materials Science · Physics 2009-01-05 D. W. Boukhvalov , M. I. Katsnelson

While graphene is a semi-metal, recently synthesized hydrogenated graphene called graphane, turns out to be an insulator. We have probed the metal insulator Transition in graphene-graphane system within the framework of density functional…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 Prachi Chandrachud , Bhalchandra S. Pujari , D. G. Kanhere

The understanding of the kinetic properties of hydrogen (isotopes) adatoms on graphene is important in many fields. The kinetic properties of hydrogen-isotope (H, D and T) monomers were simulated using a composite method consisting of…

Materials Science · Physics 2011-01-04 L. F. Huang , M. Y. Ni , X. H. Zheng , W. H. Zhou , Y. G. Li , Z. Zeng

We present an ab-initio study of electron mobility and electron-phonon coupling in chemically modified graphene, considering fluorinated and hydrogenated graphene at different percentage coverage. Hexagonal Boron Carbon Nitrogen (h-BCN) is…

Materials Science · Physics 2011-12-02 Samantha Bruzzone , Gianluca Fiori

Chemical functionalization has proven to be a promising means of tailoring the unique properties of graphene. For example, hydrogenation can yield a variety of interesting effects, including a metal-insulator transition or the formation of…

Mesoscale and Nanoscale Physics · Physics 2025-06-06 Jose E. Barrios Vargas , Jesper T. Falkenberg , David Soriano , Aron W. Cummings , Mads Brandbyge , Stephan Roche

Graphene hosts a unique electron system in which electron-phonon scattering is extremely weak but electron-electron collisions are sufficiently frequent to provide local equilibrium above liquid nitrogen temperature. Under these conditions,…

Understanding how water wets graphene is critical for predicting and controlling its behaviour in nanofluidic, sensing, and energy applications. A key measure of wetting is the contact angle made by a liquid droplet against the surface, yet…

Mesoscale and Nanoscale Physics · Physics 2026-05-04 Darren Wayne Lim , Xavier R. Advincula , William C. Witt , Angelos Michaelides , Fabian L. Thiemann , Christoph Schran

Using density-functional calculations, we show that electron or hole doped graphene can strongly change the mobility of adsorbed atoms H and O. Interestingly, charge doping affects the diffusion of H and O in the opposite way, namely,…

Computational Physics · Physics 2016-08-04 Manh-Thuong Nguyen , Pham Nam Phong

We demonstrate a graphene-based Salisbury screen consisting of a single layer of graphene placed in close proximity to a gold back reflector. The light absorption in the screen can be actively tuned by electrically gating the carrier…

Mesoscale and Nanoscale Physics · Physics 2014-09-09 Vrinda Thareja , Juhyung Kang , Hongtao Yuan , Kaveh M. Milaninia , Harold Y. Hwang , Yi Cui , Mark L. Brongersma

We model boron and nitrogen doped/codoped monolayer graphene to study its stability, interaction energy, electronic and thermal properties using density functional theory. It is found that a doped graphene sheet with non-bonded B or N atoms…

Mesoscale and Nanoscale Physics · Physics 2020-03-18 Nzar Rauf Abdullah , Hunar Omar Rashid , Mohammad T. Kareem , Chi-Shung Tang , Andrei Manolescu , Vidar Gudmundsson

We study the dependence of mechanical conformations of graphene sheets located on flat substrates on the density of unilateral (one-side) attachment of hydrogen, fluorine or chlorine atoms to them. It is shown that chemically modified…

Mesoscale and Nanoscale Physics · Physics 2020-01-08 Alexander V. Savin , Yuriy A. Kosevich

Recent experiments show that a substantial energy gap in graphene can be induced via patterned hydrogenation on an iridium substrate. Here, we show that the energy gap is roughly proportional to $\sqrt{N_{H}}/N_{C}$ when disorder is…

Mesoscale and Nanoscale Physics · Physics 2011-11-22 Roberto Grassi , Tony Low , Mark Lundstrom

The influence of pure statistical fluctuations on $K/\pi$ ratio is investigated in an event-by-event way. Poisson and the modified negative binomial distributions are used as the multiplicity distributions since they both have statistical…

High Energy Physics - Phenomenology · Physics 2016-12-21 C. B. Yang , X. Cai

To minimize parasitic doping effects caused by uncontrolled material adsorption, graphene is often investigated under vacuum. Here we report an entirely unexpected phenomenon occurring in vacuum systems, namely strong n-doping of graphene…

Mesoscale and Nanoscale Physics · Physics 2013-11-11 Christophe Caillier , Dong-Keun Ki , Yuliya Lisunova , Iaroslav Gaponenko , Patrycja Paruch , Alberto F. Morpurgo

One of the salient features of graphene is the very high carrier mobility that implies tremendous potential for use in electronic devices. Unfortunately, transport measurements find the expected high mobility only in freely suspended…

Mesoscale and Nanoscale Physics · Physics 2015-06-04 Søren Ulstrup , Marco Bianchi , Richard Hatch , Dandan Guan , Alessandro Baraldi , Dario Alfè , Liv Hornekær , Philip Hofmann

The polarization of graphene is calculated exactly within the random phase approximation for arbitrary frequency, wave vector, and doping. At finite doping, the static susceptibility saturates to a constant value for low momenta. At $q=2…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 B. Wunsch , T. Stauber , F. Sols , F. Guinea

Hydrodynamics and collision dominated transport are crucial to understand the slow dynamics of many correlated quantum liquids. The ratio \eta/s of the shear viscosity \eta to the entropy density s is uniquely suited to determine how…

Mesoscale and Nanoscale Physics · Physics 2009-07-14 Markus Mueller , Joerg Schmalian , Lars Fritz

Hydrogenated graphene, graphane, is studied on oxygen-terminated silicon dioxide substrate using ab initio calculations. A structure with hydrogenation only on one side of the graphene layer is found stable and its hydrogen configurations…

Mesoscale and Nanoscale Physics · Physics 2011-07-13 M. Ijäs , P. Havu , A. Harju , P. Pasanen