相关论文: Anomalous magnetism in hydrogenated graphene
To elucidate the physics underling magnetism observed in nominally nonmagnetic materials with only $sp$-electrons, we built an extreme model to simulate H-adsorption (in a straight-line form) on graphene. Our first principles calculations…
By applying tight binding model of adatoms in graphene, we study theoretically the localized aspects of the interaction between transition metal atoms and graphene. Considering the electron-electron interaction by adding a Hubbard term in…
In this paper, by considering the Hubbard model on a honeycomb lattice, we developed a theory for the intrinsic magnetic impurities (MIs) with the quasi-localized spin moments induced by the vacancies in graphene. Because the intrinsic MIs…
Motivated by recent developments in twisted bilayer graphene moir\'e superlattices, we investigate the effects of electron-electron interactions in a honeycomb lattice with an applied periodic potential using a finite-temperature…
Isolated hydrogen atoms absorbed on graphene are predicted to induce magnetic moments. Here we demonstrate that the adsorption of a single hydrogen atom on graphene induces a magnetic moment characterized by a ~20 meV spin-split state at…
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…
Taking into account the possibility of a p-wave hybridization function $V(\vec k)$ of ad-atom with Dirac electrons in graphene -- which arises for vacancies and hollow-site impurities -- we study the nature of magnetic moment formation…
The Hubbard model on the honeycomb lattice is a well known model for graphene. Equally well known is the Peierls type of instability of the lattice bond lengths. In the context of these two approximations we ask and answer the question of…
The effect of electronic interactions in graphene with vacancies or resonant scatterers is investigated. We apply dynamical mean-field theory in combination with quantum Monte Carlo simulations, which allow us to treat non-perturbatively…
We study from first principles the magnetism in graphene induced by single carbon atom defects. For two types of defects considered in our study, the hydrogen chemisorption defect and the vacancy defect, the itinerant magnetism due to the…
A novel magnetic ground state is reported for the Hubbard Hamiltonian in strained graphene. When the chemical potential lies close to the Dirac point, the ground state exhibits locally both the N\'{e}el and ferromagnetic orders, even for…
It is shown that a strong impurity potential induces short-range antiferromagnetic (ferrimagnetic) order around itself in a Hubbard model on a half-filled honeycomb lattice. This implies that short-range magnetic order is induced in…
Using density-functional calculations, we study the effect of sp$^3$-type defects created by different covalent functionalizations on the electronic and magnetic properties of graphene. We find that the induced magnetic properties are {\it…
Properties in magnetic ordered states of graphene nanoribbons with zigzag shaped edges are investigated by applying mean-field approximation to the Hubbard model with on-site repulsion $U$. We observe that magnetic moments and critical…
We employ large-scale quantum Monte Carlo simulations to study the magnetic ordering transition among dilute magnetic moments randomly localized on the graphene honeycomb lattice, induced by long-ranged RKKY interactions at low charge…
Graphene-like materials can be effectively described by Quantum Electrodynamics in (2+1)-dimensions. In a pristine state, these systems exhibit a symmetry between the nonequivalent Dirac points in the honeycomb lattice. Realistic samples…
The local properties of bilayer graphene (BLG) due to the spatial inhomogeneity of its sublattices are of interest. We apply Anderson impurity model to consider the local moment formation on a magnetic impurity which could be adsorbed on…
We investigate the ordering instability of interacting (and for simplicity, spinless) fermions on graphene's honeycomb lattice by numerically computing the Hartree self-consistent solution for the charge-density-wave order parameter in…
We study the orbital magnetism of graphene ribbon in the effective-mass approximation, to figure out the finite-size effect on the singular susceptibility known in the bulk limit. We find that the susceptibility at T = 0 oscillates between…
The adsorption of an alkali-metal submonolayer on graphene occupying every third hexagon of the honeycomb lattice in a commensurate $(\sqrt{3}\times\sqrt{3})R30^\circ$ arrangement induces an energy gap in the spectrum of graphene. To…