Related papers: Metal-Insulator transition in strained Graphene: A…
We determine the phase diagram of the Kane-Mele model with a long-range Coulomb interaction using an exact quantum Monte Carlo method. Long-range interactions are expected to play a role in honeycomb materials because the vanishing density…
We employ the dynamical mean field approximation to study the effects of ionic potential ($\Delta$) on the square lattice Hubbard model. At half-filling when the staggered potential ($\Delta$) dominates the on-site Hubbard interaction…
We investigate the effect of an applied uniaxial strain on the ferromagnetic instability due to long- range Coulomb interaction between Dirac fermions in graphene. In case of undeformed graphene the ferromagnetic exchange instability occurs…
We study the boundary physics of bulk insulators by considering three coupled Hubbard chains in a linear confining potential. In the Hartree-Fock approximation, the ground state at and slightly off the particle-hole symmetric point remains…
Recent experimental discovery of several families of kagome-lattice materials has boosted the interest in electronic correlations on kagome lattice. As an initial step to understand the observed complex phenomena, it is helpful to know the…
We study the Hubbard-Holstein model, which includes both the electron-electron and electron-phonon interactions characterized by $U$ and $g$, respectively, employing the dynamical mean-field theory combined with Wilson's numerical…
We present a Monte Carlo study of the finite temperature properties of an extended Hubbard-Peierls model describing one dimensional $\pi$-conjugated polymers. The model incorporates electron-phonon and hyperfine interaction and it is solved…
We study the single-orbital Hubbard model on the half-filled decorated honeycomb lattice. In the non-interacting theory at half-filling the Fermi energy lies within a flat band where strong correlations are enhanced. The lattice is highly…
Extensive investigations on the Moir\'e magic-angle have been conducted in twisted bilayer graphene, unlocking the mystery of unconventional superconductivity and insulating states. In analog to magic angle, here we demonstrate the new…
We investigate the competition between the spin-orbit interaction of itinerant electrons and their Kondo coupling with local moments densely distributed on the honeycomb lattice. We find that the model at half-filling displays a quantum…
A comparative study is made on the metal-insulator transition of Dirac fermions in the honeycomb and \pi-flux Hubbard models at half filling by means of the variational cluster approximation and cluster dynamical impurity approximation.…
We report a strain-controlled tuning of magnetism in transition-metal-atom-decorated graphene. Our first-principles calculations demonstrate that strain can lead to a sudden change in the magnetic configuration of a transition metal (TM)…
Employing a combination of functional renormalization group calculations and projective determinantal quantum Monte Carlo simulations, we examine the Hubbard model on the square lattice bilayer at half filling. From this combined analysis,…
We study ground-state properties of the two-dimensional Hubbard model at half filling by improving variational Monte Carlo method and by implementing quantum-number projection and multi-variable optimization. The improved variational wave…
We numerically study the interplay between superconductivity and disorder on the graphene honeycomb lattice with on-site Hubbard attractive interactions U using a spatially inhomogeneous self-consistent Bogoliubov-de Gennes (BdG) approach.…
We use driven Monte Carlo dynamics to study the resistive behavior of superconducting Josephson junction arrays on a honeycomb lattice in a magnetic field corresponding to $f$ flux quantum per plaquette. While for $f=1/3$ the onset of zero…
We show that as the result of the nesting property of the Fermi surface, the quarter-doped Hubbard model on honeycomb lattice is unstable with respect to the formation of a magnetic insulating state with nonzero spin chirality for…
We study thermodynamics of the 3D Hubbard model at half filling on approach to the N\'eel transition by means of large-scale unbiased Diagrammatic Determinant Monte Carlo simulations. We obtain the transition temperature in the strongly…
The pressure-induced structural phase transition from diamond to beta-tin in silicon is an excellent test for theoretical total energy methods. The transition pressure provides a sensitive measure of small relative energy changes between…
Crystal structures of $\textrm{CLi}_4$ compounds are explored through \emph{ab} \emph{initio} evolutionary methodology. Phase transition from metal to semimetal and semiconductor, and eventually to insulator with increasing pressure are…