Related papers: Orbital-selective Mott phases of a one-dimensional…
We present a strategy to alleviate the sign problem in continuous-time quantum Monte Carlo (CTQMC) simulations of the dynamical-mean-field-theory (DMFT) equations for the spin-orbit-coupled multiorbital Hubbard model. We first identify the…
An efficient perturbational treatment of spin-orbit coupling within the framework of high-level multi-reference techniques has been implemented in the most recent version of the COLUMBUS quantum chemistry package, extending the existing…
We present a detailed study of the Bose-Hubbard model in a $p$-band triangular lattice by focusing on the evolution of orbital order across the superfluid-Mott insulator transition. Two distinct phases are found in the superfluid regime.…
Spin-liquid behavior was recently suggested experimentally in the moderately one-dimensional organic compound $\kappa$-H$_3$(Cat-EDT-TTF)$_2$. This compound can be modeled by the one-band Hubbard model on the anisotropic triangular lattice…
Tight-binding Hamiltonians with single and multiple orbitals exhibit an intriguing array of magnetic phase transitions. In most cases the spin ordered phases are insulating, while the disordered phases may be either metallic or insulating.…
High harmonic generation in the interaction of femtosecond lasers with atoms and molecules opens the path to molecular orbital tomography and to probe the electronic dynamics with attosecond-{\AA}ngstr\"{o}m resolutions. Molecular orbital…
A U(1) slave-spin representation is introduced for multi-orbital Hubbard models. As with the $Z_2$ form of L. de'Medici et al. (Phys. Rev. B 72, 205124 (2005)), this approach represents a physical electron operator as the product of a slave…
We present a comprehensive study of the spin excitations - as measured by the dynamical spin structure factor $S(q,\omega)$ - of the so-called block-magnetic state of low-dimensional orbital-selective Mott insulators. We realize this state…
We study one-dimensional truncated (no more than 2 particles on a site) bosonic Hubbard model in both repulsive and attractive regimes by exact diagonalization and exact worldline Monte Carlo simulation. In the commensurate case (one…
Motivated by the recent discovery of Fe-based superconductors close to an antiferromagnetic insulator in the experimental phase diagram, here the five-orbital Hubbard model (without lattice distortions) is studied using the real-space…
We introduce methodology for real-time inference in general-state-space hidden Markov models. Specifically, we extend recent advances in controlled sequential Monte Carlo (CSMC) methods-originally proposed for offline smoothing-to the…
The competition between commensurate and incommensurate spin-density-wave phases in the infinite-dimensional single-band Hubbard model is examined with quantum Monte Carlo simulation and strong and weak coupling approximations. Quantum…
Gaussian Quantum Monte Carlo (GQMC) is a stochastic phase space method for fermions with positive weights. In the example of the Hubbard model close to half filling it fails to reproduce all the symmetries of the ground state leading to…
We propose a new scheme to implement the self-consistent optimization of the trial wave-function in constrained path auxiliary field Quantum Monte Carlo (CP-AFQMC) in the framewok of natural orbitals. In this scheme, a new trial…
We have investigated the antiferromagnetic phase of the 2D, the 3D and the extended Hubbard models on a bipartite cubic lattice by means of the Composite Operator Method within a two-pole approximation. This approach yields a fully…
By imaginary-time evolution with Hamiltonian, an arbitrary state arrives in the system's ground state. In this work, we conjecture that this dynamics can be simulated by measurement-only circuit (MoC), where each projective measurement is…
State space models (SSM) have been widely applied for the analysis and visualization of large sequential datasets. Sequential Monte Carlo (SMC) is a very popular particle-based method to sample latent states from intractable posteriors.…
In ruthenate materials, non-Fermi liquid (NFL) phases have been observed. We used the natural orbitals renormalization group (NORG) method as an impurity solver for dynamical mean-field theory (DMFT) to study a three-orbital…
Topological phase transitions challenge conventional paradigms in many-body physics by separating phases that are locally indistinguishable yet globally distinct. Using a quantum simulator of interacting erbium atoms in an optical lattice,…
The Hubbard model on an anisotropic triangular lattice in two dimensions, a fundamental model for frustrated electron physics, displays a wide variety of phases and phase transitions. This work investigates the model using the ladder dual…