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Adsorption of hydrogen atoms to a carbon atom vacancy in graphene is investigated by means of periodic \emph{first principles} calculations, up to the fully hydrogenated state where six H atoms chemically bind to the vacancy. Addition of a…

Materials Science · Physics 2013-12-30 M. Casartelli , S. Casolo , G. F. Tantardini , R. Martinazzo

Room temperature ferromagnetic materials composed only by light elements like carbon, hydrogen and/or nitrogen, so called carbon magnet, are very attractive for creating new material categories both in science and industry. Recently several…

Mesoscale and Nanoscale Physics · Physics 2011-01-24 Norio Ota , Narjes Gorjizadeh , Yoshiyuki Kawazoe

Orbital magnetism is studied for graphene flakes with various shapes and edge configurations using the tight-binding approximation. In the low-temperature regime where the thermal energy is much smaller than to the energy level spacing, the…

Mesoscale and Nanoscale Physics · Physics 2013-03-27 Yuya Ominato , Mikito Koshino

We examine the conditions necessary for the presence of localized magnetic moments on adatoms with inner shell electrons in graphene. We show that the low density of states at the Dirac point, and the anomalous broadening of the adatom…

Strongly Correlated Electrons · Physics 2008-07-13 Bruno Uchoa , Valeri N. Kotov , N. M. R. Peres , A. H. Castro Neto

Structural as well as magnetization studies have been carried out on graphite samples irradiated by neutrons over 50 years in the CIRUS research reactor at Trombay. Neutron diffraction studies reveal that the defects in irradiated graphite…

Magnetic order emerging in otherwise non-magnetic materials as carbon is a paradigmatic example of a novel type of s-p electron magnetism predicted to be of exceptional high-temperature stability. It has been demonstrated that atomic scale…

Recent experimental evidence that fluorinated graphene creates local magnetic moments around F adatoms has not been supported by semilocal density-functional theory (DFT) calculations where the adsorption of an isolated F adatom induces no…

Mesoscale and Nanoscale Physics · Physics 2013-06-03 Hyun-Jung Kim , Jun-Hyung Cho

Carbon atom vacancies in graphene give rise to a local magnetic moment of $\sigma+\pi$ origin, whose magnitude is yet uncertain and debated. Partial quenching of $\pi$ magnetism has been ubiquitously reported in periodic $first-principles$…

Materials Science · Physics 2023-02-27 Mirko Leccese , Rocco Martinazzo

Hydrogen adatoms are one of the most the promising proposals for the functionalization of graphene. Hydrogen induces narrow resonances near the Dirac energy, which lead to the formation of magnetic moments. Furthermore, they also create…

Mesoscale and Nanoscale Physics · Physics 2018-04-24 Luis A. González-Árraga , J. L. Lado , F. Guinea

Several experiments have recently found room-temperature ferromagnetism in graphite-like carbon based materials. This paper offers a model explaining such ferromagnetism by using an asymmetric nano-graphene. Our first typical model is…

Mesoscale and Nanoscale Physics · Physics 2011-01-28 Norio Ota , Narjes Gorjizadeh , Yoshiyuki Kawazoe

We study the spin relaxation in graphene due to magnetic moments induced by defects. We propose and employ in our studies a microscopic model that describes magnetic impurity scattering processes mediated by charge puddles. This model…

Mesoscale and Nanoscale Physics · Physics 2019-08-28 Vladimir G. Miranda , Eduardo R. Mucciolo , Caio H. Lewenkopf

Void-defect is a possible origin of ferromagnetic feature on pure carbon materials. In our previous paper, void-defect on graphene-nanoribbon show highly polarized spin configuration. In this paper, we studied cases for graphene molecules…

Astrophysics of Galaxies · Physics 2021-07-06 Norio Ota , Aigen Li , Laszlo Nemes , Masaaki Otsuka

Magnetic properties of a single vacancy in graphene is a relevant and still unsolved problem. The experimental results point to a clearly detectable magnetic defect state at the Fermi energy, while several calculations based on density…

Mesoscale and Nanoscale Physics · Physics 2017-10-11 A. M. Valencia , M. J. Caldas

The problem of a magnetic impurity, atomic or molecular, absorbed on top of a carbon atom in otherwise clean graphene is studied using the numerical renormalization group. The spectral, thermodynamic, and scattering properties of the…

Strongly Correlated Electrons · Physics 2009-01-27 P. S. Cornaglia , Gonzalo Usaj , C. A. Balseiro

Despite fermion doubling, a two-dimensional quasi-relativistic spin-1/2 system can still lead to true fractionalization of electrical charge, when a massive ordered phase supports a "half-vortex". Such topological defect is possible when…

Mesoscale and Nanoscale Physics · Physics 2016-04-13 Bitan Roy , Igor F. Herbut

The arguments supporting the existence of the intrinsic magnetism in carbon-based materials including pure graphene were analyzed critically together with the numerous experimental evidences denying the magnetism in these materials. The…

Strongly Correlated Electrons · Physics 2012-10-16 A. L. Kuzemsky

At the heart of current information nanotechnology lies the search for ideal platforms hosting the smallest possible magnets, i.e. single atoms with magnetic moments pointing out-of-plane, as requested in a binary-type of memory. For this…

We measure the dependence of the conductivity of graphene as a function of magnetic field, temperature and carrier density and discover a saturation of the dephasing length at low temperatures that we ascribe to spin memory effects. Values…

Mesoscale and Nanoscale Physics · Physics 2015-05-30 A. A. Kozikov , D. W. Horsell , E. McCann , V. I. Fal'ko

We address the electronic structure and magnetic properties of vacancies and voids both in graphene and graphene ribbons. Using a mean field Hubbard model, we study the appearance of magnetic textures associated to removing a single atom…

Mesoscale and Nanoscale Physics · Physics 2008-11-27 J. J. Palacios , J. Fernandez-Rossier , L. Brey

A lot of efforts have been devoted to understanding the origin and effects of magnetic moments induced in graphene with carbon atom vacancy, or light adatoms like hydrogen or fluorine. At the meantime, the large negative magnetoresistance…

Mesoscale and Nanoscale Physics · Physics 2020-07-08 Shimin Cao , Chuanwu Cao , Shibing Tian , Jian-Hao Chen