Related papers: Quantum Monte Carlo Study of Semiconductor Artific…
The ability to accurately predict the finite temperature properties of realistic quantum solids is central to uncovering new phases and engineering materials with novel properties. Nonetheless, there remain comparatively few many-body…
Building on recent solutions of the fermion sign problem for specific models we present two continuous-time quantum Monte Carlo methods for efficient simulation of mass-imbalanced Hubbard models on bipartite lattices at half-filling. For…
We propose a quantum gate architecture that allows for the systematic control of the effective exchange interactions between magnetic impurities embedded in nano-scale graphene flakes connected by a gated bridge. The entanglement between…
We present an \textit{ab initio} auxiliary field quantum Monte Carlo method for studying the electronic structure of molecules, solids, and model Hamiltonians at finite temperature. The algorithm marries the \textit{ab initio} phaseless…
We study in this paper the phase transition in superlattices formed by alternate magnetic and ferroelectric layers, by the use of Monte Carlo simulation. We study effects of temperature, external magnetic and electric fields,…
We report the magneto-transport properties of a two-dimensional electron gas in a modulation-doped AlGaAs/GaAs heterostructure subjected to a lateral potential with honeycomb geometry. Periodic oscillations of the magneto-resistance and a…
The $2d$ Hubbard model with nearest-neighbour hopping on the square lattice and an average of one electron per site is known to undergo an extended crossover from metallic to insulating behavior driven by proliferating antiferromagnetic…
We use large scale quantum Monte-Carlo simulations to study an extended Hubbard model of hardcore bosons on the kagome lattice. In the limit of strong nearest-neighbor interactions at 1/3 filling, the interplay between frustration and…
The honeycomb antiferromagnet under a triaxial strain is studied using the quantum Monte Carlo simulation. The strain dimerizes the exchange couplings near the corners, thus destructs the antiferromagnetic order therein. The…
Using finite-temperature determinantal quantum Monte Carlo simulations, we examine the thermodynamic properties of the extended Hubbard model on the half-filled square lattice in the Slater regime at intermediate coupling. We consider both…
The Quantum Monte-Carlo simulations of the two-dimensional Hubbard model are presented for the half filling. The method based on the direct-space proposed by Suzuki and al., and Hirsch and al. was used. The states generated by this method…
In this paper, we study the defects effect on magnetic properties of a nano-square structure. This system is composed with alternate layers consisting of the spins {\sigma}=3/2 and S=1. More precisely, we examine the effect of different…
In this work we focus on the study of phase separation in the zero-bandwidth extended Hubbard with nearest-neighbors intersite Ising-like magnetic interactions $J$ and on-site Coulomb interactions $U$. The system has been analyzed by means…
We use Quantum Monte Carlo simulations and exact diagonalization to explore the phase diagram of the Bose-Hubbard model with an additional superlattice potential. We first analyze the properties of superfluid and insulating phases present…
Mean-field approximation is often used to explore the qualitative behaviour of phase transitions in classical spin models before employing computationally costly methods such as the Monte-Carlo techniques. We implement a 'lattice…
We show that for the half-filled Kondo lattice model on the honeycomb lattice a Kondo breakdown occurs at small Kondo couplings $J_k$ within the magnetically ordered phase. Our conclusions are based on auxiliary field quantum Monte Carlo…
The Quantum Monte Carlo simulations of the ionic Hubbard model on a two-dimensional square lattice at half filling were performed. The method based on the direct-space, proposed by Suzuki and al., Hirsch and al., was used. Cycles of…
We systematically investigate the emergence of electron crystal phases in rhombohedral multilayer graphene using comprehensive self-consistent Hartree Fock calculations combined with \textit{ab initio} tight binding model. As the carrier…
We present numerical studies of quantum walks on \C60 and related graphene structures, to investigate their transport properties. Also known as a \emph{honeycomb lattice}, the lattice formed by carbon atoms in the graphene phase can be…
We study the effect of Coulomb interaction between charge carriers on the properties of graphene monolayer, assuming that the strength of the interaction is controlled by the dielectric permittivity of the substrate on which the graphene…