相关论文: Broken-symmetry magnetic phases in two-dimensional…
We study the emergence of magnetism and its interplay with structural properties in a two dimensional molecular crystal of cyclacenes, using density functional theory (DFT). Isolated cyclacenes with an even number of fused benzenes host two…
We introduce a spin-symmetry-broken extension of the connected determinant algorithm [Phys. Rev. Lett. 119, 045701 (2017)]. The resulting systematic perturbative expansions around an antiferromagnetic state allow for numerically exact…
The competition between antiferromagnetic and spin-singlet ground states within quantum spin models and the 1/2-filled band Hubbard model has received intense scrutiny. Here we demonstrate a frustration-induced transition from N\'{e}el…
The ground states of two types of distorted mixed diamond chains with spins 1 and 1/2 are investigated using exact diagonalization, DMRG, and mapping onto low-energy effective models. In the undistorted case, the ground state consists of an…
Equilateral triangle-shaped graphene nanoislands with a lateral dimension of $n$ benzene rings are known as $[n]$triangulenes. Individual $[n]$triangulenes are open-shell molecules, with single-particle electronic spectra that host $n-1$…
We present new numerical tools to analyze symmetry-broken phases in the context of $SU(2)$-symmetric translation-invariant matrix product states (MPS) and density-matrix renormalization-group (DMRG) methods for infinite cylinders, and…
We implement a self-consistent Hartree-Fock approximation based on a microscopic model in real space, which allows us to consider the interplay between the Hubbard and the extended Coulomb interaction in twisted bilayer graphene at the…
The spin-1/2 Heisenberg model on the pyrochlore lattice is an iconic frustrated three-dimensional spin system with a rich phase diagram. Besides hosting several ordered phases, the model is debated to possess a spin-liquid ground state when…
The prospect of merging the paradigms of geometric frustration on a triangular lattice and bond anisotropies in the strong spin-orbit coupling limit holds tremendous promise in the ongoing hunt for exotic quantum materials. Here we identify…
We study the classical antiferromagnetic Heisenberg model on the triangular lattice with Dzyaloshinskii-Moriya interactions in a magnetic field. We focus in particular in the emergence of a composite spin crystal phase, dubbed…
Twisted bilayer graphene is an exciting platform for exploring correlated quantum phases, extremely tunable with respect to both the single-particle bands and the interaction profile of electrons. Here, we investigate the phase diagram of…
Based on classical density functional theory (DFT), we investigate the demixing phase transition of a two-dimensional, binary Heisenberg fluid mixture. The particles in the mixture are modeled as Gaussian soft spheres, where one component…
We propose a lattice scale two-band generalized Hubbard model as a caricature of the electronic structure of twisted bilayer graphene. Various possible broken symmetry phases can arise, including a nematic phase (which is a form of orbital…
We look into the quantum phase diagram of a spin-$\frac{1}{2}$ antiferromagnet on the square lattice with degenerate Shastry-Sutherland ground states, for which only a schematic phase diagram is known so far. Many exotic phases were…
The non-interacting energy spectrum of graphene and its bilayer counterpart consists of multiple degeneracies owing to the inherent spin, valley and layer symmetries. Interactions among charge carriers are expected to spontaneously break…
We investigate the interplay between frustration and zero-point quantum fluctuations in the ground state of the triangular and $J_1{-}J_2$ Heisenberg antiferromagnets, using finite-size spin-wave theory, exact diagonalization, and quantum…
We study crystal melting in two-dimensional antiferromagnets, by analyzing the statistical mechanics of the six-state clock model on a lattice in which defects (dislocations and disclinations) are allowed to appear. We show that the…
We show that the spin-density wave state on the partially filled honeycomb and triangular lattices is preempted by a paramagnetic phase that breaks an emergent Z_4 symmetry of the system, associated with the four inequivalent arrangements…
We study the magnetic phases of two coupled two-dimensional electron gases in order to determine under what circumstances these phases may occur in real semiconductor quantum wells and what the experimental properties of the broken-symmetry…
We study ordered phases with broken translational symmetry in the half-filled three-orbital Hubbard model with antiferromagnetic Hund coupling by means of dynamical mean-field theory (DMFT) and continuous-time quantum Monte Carlo…