The authors investigate how the statistics of the expansion order in a quantum Monte Carlo simulation is affected by the presence of a quantum critical point and illustrate these effects on the impurity quantum phase transition in a superconducting quantum dot.
Phase transitions have been an active area of research in statistical mechanics for almost a century and have recently been integrated into quantum mechanics. Many phenomena such as superconductivity and unconventional magnetism are understood to arise from exotic quantum phases and at points describing quantum phase transitions. A detailed understanding of these phase transitions requires numerical simulations of models which benchmark realistic models against theoretical frameworks. The topic of this thesis is the implementation of Quantum Monte Carlo simulation, which is a powerful technique to understand quantum condensed matter, in interesting models to illustrate novel phenomena in magnetic systems. The novel features of condensed matter systems described in this thesis consist of emergent symmetries at critical points, interesting dynamical features of such systems and the drastic effects of defects in spin systems used in the field of adiabatic quantum computing. Emergent symmetries are shown by condensed matter systems especially at critical points and are features which cannot be shown by individual or a small number of spins. Examples of this in one and two dimensions are presented in an early chapter of this thesis. In addition to this, spin systems can show excitations which have an interesting spatial structure as a consequence of restricted dynamics which only allow the excitations to spread in a particular region. This is presented in the context of a simple model in the following chapter along with numerical support. The following chapter contains a description of adiabatic quantum computing along with a particular model which we study. The phase transition and the effects on the performance of adiabatic quantum computing are studied in this context.
Metallic quantum critical phenomena are believed to play a key role in many strongly correlated materials, including high-temperature superconductors. Theoretically, the problem of quantum criticality in the presence of a Fermi surface has proven to be highly challenging. However, it has recently been realized that many models used to describe such systems are amenable to numerically exact solution by quantum Monte Carlo (QMC) techniques, without suffering from the fermion sign problem. In this review, we examine the status of the understanding of metallic quantum criticality and the recent progress made by QMC simulations. We focus on the cases of spin-density wave and Ising nematic criticality. We describe the results obtained so far and their implications for superconductivity, non-Fermi liquid behavior, and transport near metallic quantum critical points. Some of the outstanding puzzles and future directions are highlighted.
We study two planar square lattice Heisenberg models with explicit dimerization or quadrumerization of the couplings in the form of ladder and plaquette arrangements. We investigate the quantum critical points of those models by means of (stochastic series expansion) quantum Monte Carlo simulations as a function of the coupling ratio $\ensuremath{\alpha}={J}^{\ensuremath{'}}/J$. The critical point of the order-disorder quantum phase transition in the ladder model is determined as ${\ensuremath{\alpha}}_{c}=1.9096(2)$ improving on previous studies. For the plaquette model, we obtain ${\ensuremath{\alpha}}_{c}=1.8230(2)$ establishing a first benchmark for this model from quantum Monte Carlo simulations. Based on those values, we give further convincing evidence that the models are in the three-dimensional classical Heisenberg universality class. The results of this contribution shall be useful as references for future investigations on planar Heisenberg models such as concerning the influence of nonmagnetic impurities at the quantum critical point.
Continuous quantum phase transitions are characterized by an order parameter and correlation functions that are often challenging to access experimentally or in direct numerical simulations. The energy of an added impurity can on the other hand be probed by established polaron spectroscopy, or numerically with Monte Carlo methods. We provide evidence from ground-state quantum Monte Carlo calculations that the energy of a mobile impurity interacting weakly with a surrounding lattice Bose gas provides access to the critical behavior of the Mott insulator-superfluid phase transition. Finite-size scaling of the energy reveals that its value is scale invariant at the critical point of the quantum phase transition, and we extract a scaling exponent that is currently unexplained by theory. For a small lattice we further observe a flattening of the impurity-boson density-density correlations at the critical point, which hints at a divergence of a corresponding length scale in the thermodynamic limit. Our results suggest that impurity spectroscopy represents a useful way to probe the critical properties of quantum phase transitions in general.