arXiv subjects

A. W. Sandvik

Publications and source records attributed to A. W. Sandvik.

At least 19 recordsLinked to original sources

arXiv2019

Temperature dependence of the $(π,0)$ anomaly in the excitation spectrum of the 2D quantum Heisenberg antiferromagnet

It is well established that in the low-temperature limit, the two-dimensional quantum Heisenberg antiferromagnet on a square lattice (2DQHAFSL) exhibits an anomaly in its spectrum at short-wavelengths on the zone-boundary. In the vicinity of the $(π,0)$ point the pole in the one-magnon response exhibits a downward dispersion, is heavily damped and attenuated, giving way to an isotropic continuum of excitations extending to high energies. The origin of the anomaly and the presence of the continuum are of current theoretical interest, with suggestions focused around the idea that the latter evidences the existence of spinons in a two-dimensional system. Here we present the results of neutron inelastic scattering experiments and Quantum Monte Carlo calculations on the metallo-organic compound Cu(DCOO)$_2\cdot 4$D$_2$O (CFTD), an excellent physical realisation of the 2DQHAFSL, designed to investigate how the anomaly at $(π,0)$ evolves up to finite temperatures $T/J\sim2/3$. Our data reveal that on warming the anomaly survives the loss of long-range, three-dimensional order, and is thus a robust feature of the two-dimensional system. With further increase of temperature the zone-boundary response gradually softens and broadens, washing out the $(π,0)$ anomaly. This is confirmed by a comparison of our data with the results of finite-temperature Quantum Monte Carlo simulations where the two are found to be in good accord. At lower energies, in the vicinity of the antiferromagnetic zone centre, there was no significant softening of the magnetic excitations over the range of temperatures investigated.

cond-mat.str-el↗

arXiv2014

Universal dynamic scaling in three-dimensional Ising spin glasses

We use a non-equilibrium simulation method to study the spin glass transition in three-dimensional Ising spin glasses. The transition point is repeatedly approached at finite velocity $v$ (temperature change versus time) in Monte Carlo simulations starting at a high temperature. The normally problematic critical slowing-down is not hampering this kind of approach, since the system equilibrates quickly at the initial temperature and the slowing-down is merely reflected in the dynamic scaling of the non-equilibrium order parameter with $v$ and the system size. The equilibrium limit does not have to be reached. For the dynamic exponent we obtain $z = 5.85(9)$ for bimodal couplings distribution and $z=6.00(10)$ for the Gaussian case, thus supporting universal dynamic scaling (in contrast to recent claims of non-universal behavior).

cond-mat.dis-nn↗

arXiv2013

Finite-size scaling method for the Berezinskii-Kosterlitz-Thouless transition

We test an improved finite-size scaling method for reliably extracting the critical temperature $T_{\rm BKT}$ of a Berezinskii-Kosterlitz-Thouless (BKT) transition. Using known single-parameter logarithmic corrections to the spin stiffness $ρ_s$ at $T_{\rm BKT}$ in combination with the Kosterlitz-Nelson relation between the transition temperature and the stiffness, $ρ_s(T_{\rm BKT})=2T_{\rm BKT}/π$, we define a size dependent transition temperature $T_{\rm BKT}(L_1,L_2)$ based on a pair of system sizes $L_1,L_2$, e.g., $L_2=2L_1$. We use Monte Carlo data for the standard two-dimensional classical XY model to demonstrate that this quantity is well behaved and can be reliably extrapolated to the thermodynamic limit using the next expected logarithmic correction beyond the ones included in defining $T_{\rm BKT}(L_1,L_2)$. For the Monte Carlo calculations we use GPU (graphical processing unit) computing to obtain high-precision data for $L$ up to 512. We find that the sub-leading logarithmic corrections have significant effects on the extrapolation. Our result $T_{\rm BKT}=0.8935(1)$ is several error bars above the previously best estimates of the transition temperature; $T_{\rm BKT} \approx 0.8929$. If only the leading log-correction is used, the result is, however, consistent with the lower value, suggesting that previous works have underestimated $T_{\rm BKT}$ because of neglect of sub-leading logarithms. Our method is easy to implement in practice and should be applicable to generic BKT transitions.

cond-mat.stat-mech↗

arXiv2013

Microscopic theory of non-adiabatic response in real and imaginary time

We present a general approach to describe slowly driven quantum systems both in real and imaginary time. We highlight many similarities, qualitative and quantitative, between real and imaginary time evolution. We discuss how the metric tensor and the Berry curvature can be extracted from both real and imaginary time simulations as a response of physical observables. For quenches ending at or near the quantum critical point, we show the utility of the scaling theory for detecting the location of the quantum critical point by comparing sweeps at different velocities. We briefly discuss the universal relaxation to equilibrium of systems after a quench. We finally review recent developments of quantum Monte Carlo methods for studying imaginary-time evolution. We illustrate our findings with explicit calculations using the transverse field Ising model in one dimension.

cond-mat.stat-mech↗

arXiv2012

The performance of the quantum adiabatic algorithm on random instances of two optimization problems on regular hypergraphs

In this paper we study the performance of the quantum adiabatic algorithm on random instances of two combinatorial optimization problems, 3-regular 3-XORSAT and 3-regular Max-Cut. The cost functions associated with these two clause-based optimization problems are similar as they are both defined on 3-regular hypergraphs. For 3-regular 3-XORSAT the clauses contain three variables and for 3-regular Max-Cut the clauses contain two variables. The quantum adiabatic algorithms we study for these two problems use interpolating Hamiltonians which are stoquastic and therefore amenable to sign-problem free quantum Monte Carlo and quantum cavity methods. Using these techniques we find that the quantum adiabatic algorithm fails to solve either of these problems efficiently, although for different reasons.

quant-ph↗

arXiv2012

Two-orbital quantum spin model of magnetism in the iron pnictides

We study a two-orbital spin model to describe (pi,0) stripe antiferromagnetism in the iron pnictides. The "double-spin" model has an on-site Hunds's coupling and inter-site interactions extending to second neighbors (inter- and intra-orbital) on the square lattice. Using a variational method based on a cluster decomposition, we optimize wave functions with up to 8 cluster sites (up to 2^16 variational parameters). We focus on the anomalously small ordered moments in the stripe state of the pnictides. To account for it, and large variations among different compounds, we show that the second-neighbor cross-orbital exchange constant should be ferromagnetic, which leads to "partially hidden" stripe order, with a moment that can be varied over a large range by small changes in the coupling constants. In a different parameter region, we confirm the existence of a canted state previously found in spin-wave theory. We also identify several other phases of the model.

cond-mat.str-el↗

arXiv2012

Universal nonequilibrium quantum dynamics in imaginary time

We propose a method to study dynamical response of a quantum system by evolving it with an imaginary-time dependent Hamiltonian. The leading non-adiabatic response of the system driven to a quantum-critical point is universal and characterized by the same exponents in real and imaginary time. For a linear quench protocol, the fidelity susceptibility and the geometric tensor naturally emerge in the response functions. Beyond linear response, we extend the finite-size scaling theory of quantum phase transitions to non-equilibrium setups. This allows, e.g., for studies of quantum phase transitions in systems of fixed finite size by monitoring expectation values as a function of the quench velocity. Non-equilibrium imaginary-time dynamics is also amenable to quantum Monte Carlo (QMC) simulations, with a scheme that we introduce here and apply to quenches of the transverse-field Ising model to quantum-critical points in one and two dimensions. The QMC method is generic and can be applied to a wide range of models and non-equilibrium setups.

cond-mat.other↗

arXiv2010

Loop updates for variational and projector quantum Monte Carlo simulations in the valence-bond basis

We show how efficient loop updates, originally developed for Monte Carlo simulations of quantum spin systems at finite temperature, can be combined with a ground-state projector scheme and variational calculations in the valence bond basis. The methods are formulated in a combined space of spin z-components and valence bonds. Compared to schemes formulated purely in the valence bond basis, the computational effort is reduced from up to O(N^2) to O(N) for variational calculations, where N is the system size, and from O(m^2) to O(m) for projector simulations, where m>> N is the projection power. These improvements enable access to ground states of significantly larger lattices than previously. We demonstrate the efficiency of the approach by calculating the sublattice magnetization M_s of the two-dimensional Heisenberg model to high precision, using systems with up to 256*256 spins. Extrapolating the results to the thermodynamic limit gives M_s=0.30743(1). We also discuss optimized variational amplitude-product states, which were used as trial states in the projector simulations, and compare results of projecting different types of trial states.

cond-mat.str-el↗

arXiv2009

Antiferromagnetic to valence-bond-soild transitions in two-dimensional SU(N) Heisenberg models with multi-spin interactions

We study two-dimensional Heisenberg antiferromagnets with additional multi-spin interactions which can drive the system into a valence-bond solid state. For standard SU(2) spins, we consider both four- and six-spin interactions. We find continuous quantum phase transitions with the same critical exponents. Extending the symmetry to SU(N), we also find continuous transitions for N=3 and 4. In addition, we also study quantitatively the cross-over of the order-parameter symmetry from Z4 deep inside the valence-bond-solid phase to U(1) as the phase transition is approached.

cond-mat.str-el↗

arXiv2007

Variational quantum Monte Carlo simulations with tensor-network states

We show that the formalism of tensor-network states, such as the matrix product states (MPS), can be used as a basis for variational quantum Monte Carlo simulations. Using a stochastic optimization method, we demonstrate the potential of this approach by explicit MPS calculations for the transverse Ising chain with up to N=256 spins at criticality, using periodic boundary conditions and D*D matrices with D up to 48. The computational cost of our scheme formally scales as ND^3, whereas standard MPS approaches and the related density matrix renromalization group method scale as ND^5 and ND^6, respectively, for periodic systems.

cond-mat.str-el↗

arXiv2007

Anomalous Curie response of impurities in quantum-critical spin-1/2 Heisenberg antiferromagnets

We consider a magnetic impurity in two different S=1/2 Heisenberg bilayer antiferromagnets at their respective critical inter-layer couplings separating N'eel and disordered ground states. We calculate the impurity susceptibility using a quantum Monte Carlo method. With intra-layer couplings in only one of the layers (Kondo lattice), we observe an anomalous Curie constant C*, as predicted on the basis of field-theoretical work [S. Sachdev et al., Science 286, 2479 (1999)]. The value C*=0.262 +/- 0.002 is larger than the normal Curie constant C=S(S+1)/3. Our low-temperature results for the symmetric bilayer are consistent with a universal C*.

cond-mat.str-el↗

arXiv2007

Monte Carlo Simulations of Quantum Spin Systems in the Valence Bond Basis

We discuss a projector Monte Carlo method for quantum spin models formulated in the valence bond basis, using the S=1/2 Heisenberg antiferromagnet as an example. Its singlet ground state can be projected out of an arbitrary basis state as the trial state, but a more rapid convergence can be obtained using a good variational state. As an alternative to first carrying out a time consuming variational Monte Carlo calculation, we show that a very good trial state can be generated in an iterative fashion in the course of the simulation itself. We also show how the properties of the valence bond basis enable calculations of quantities that are difficult to obtain with the standard basis of Sz eigenstates. In particular, we discuss quantities involving finite-momentum states in the triplet sector, such as the dispersion relation and the spectral weight of the lowest triplet.

cond-mat.str-el↗

arXiv2007

Variational ground states of 2D antiferromagnets in the valence bond basis

We study a variational wave function for the ground state of the two-dimensional S=1/2 Heisenberg antiferromagnet in the valence bond basis. The expansion coefficients are products of amplitudes h(x,y) for valence bonds connecting spins separated by (x,y) lattice spacings. In contrast to previous studies, in which a functional form for h(x,y) was assumed, we here optimize all the amplitudes for lattices with up to 32*32 spins. We use two different schemes for optimizing the amplitudes; a Newton/conjugate-gradient method and a stochastic method which requires only the signs of the first derivatives of the energy. The latter method performs significantly better. The energy for large systems deviates by only approx. 0.06% from its exact value (calculated using unbiased quantum Monte Carlo simulations). The spin correlations are also well reproduced, falling approx. 2% below the exact ones at long distances. The amplitudes h(r) for valence bonds of long length r decay as 1/r^3. We also discuss some results for small frustrated lattices.

cond-mat.str-el↗

arXiv2006

Universal Scaling of the Neel Temperature of Near-Quantum-Critical Quasi-Two-Dimensional Heisenberg Antiferromagnets

We use a quantum Monte Carlo method to calculate the Neel temperature T_N of weakly coupled S=1/2 Heisenberg antiferromagnetic layers consisting of coupled ladders. This system can be tuned to different two-dimensional scaling regimes for T > T_N. In a single-layer mean-field theory, χ_s^{2D}(T_N)=(z_2J')^{-1}, where χ_s^{2D} is the exact staggered susceptibility of an isolated layer, J' the inter-layer coupling, and z_2=2 the layer coordination number. With a renormalized z_2, we find that this relationship applies not only in the renormalized-classical regime, as shown previously, but also in the quantum-critical regime and part of the quantum-disordered regime. The renormalization is nearly constant; k_2 ~ 0.65-0.70. We also study other universal scaling functions.

cond-mat.str-el↗

arXiv2006

Some formal results for the valence bond basis

In a system with an even number of SU(2) spins, there is an overcomplete set of states--consisting of all possible pairings of the spins into valence bonds--that spans the S=0 Hilbert subspace. Operator expectation values in this basis are related to the properties of the closed loops that are formed by the overlap of valence bond states. We construct a generating function for spin correlation functions of arbitrary order and show that all nonvanishing contributions arise from configurations that are topologically irreducible. We derive explicit formulas for the correlation functions at second, fourth, and sixth order. We then extend the valence bond basis to include triplet bonds and discuss how to compute properties that are related to operators acting outside the singlet sector. These results are relevant to analytical calculations and to numerical valence bond simulations using quantum Monte Carlo, variational wavefunctions, or exact diagonalization.

cond-mat.str-el↗

arXiv2006

Nature of the antiferromagnetic to valence-bond-solid quantum phase transition in a 2D XY-model with four-site interactions

We report large-scale quantum Monte Carlo calculations at the T=0 antiferromagnetic to valence-bond-solid (VBS) transition of a two-dimensional S=1/2 XY model with four-spin interactions. Finite-size scaling suggests a discontinuous spin stiffness, but a continuous VBS order-parameter. We propose that this is a continuous VBS transition without critical spin fluctuations. We also argue that the system is close to a point, in an extended parameter space, where both the magnetic and VBS fluctuations are critical--possibly a deconfined quantum-critical point.

cond-mat.str-el↗

arXiv2005

Correlations and confinement in non-planar two-dimensional dimer models

We study classical hard-core dimer models on the square lattice with links extending beyond nearest-neighbors. Numerically, using a directed-loop Monte Carlo algorithm, we find that, in the presence of longer dimers preserving the bipartite graph structure, algebraic correlations persist. While the confinement exponent for monomers drifts, the leading decay of dimer correlations remains 1/r^2, although the logarithmic peaks present in the dimer structure factor of the nearest-neighbour model vanish. By contrast, an arbitrarily small fraction of next-nearest-neighbor dimers leads to the onset of exponential dimer correlations and deconfinement. We discuss these results in the framework of effective theories, and provide an approximate but accurate analytical expression for the dimer correlations.

cond-mat.str-el↗

arXiv2004

Theory of the Magnetic phase diagram of LiHoF$_4$

The properties of LiHoF$_4$ are believed to be well described by a long-range dipolar Ising model. We go beyond mean-field theory and calculate the phase diagram of the Ising model in a transverse field using a quantum Monte Carlo method. The relevant Ising degrees of freedom are obtained using a non-perturbative projection onto the low-lying crystal field eigenstates. We explicitly take the domain structure into account, and the strength of the near-neighbor exchange interaction is obtained as a fitting parameter. The on-site hyperfine interaction is approximately taken into account through a renormalization of the transverse applied magnetic field. Finally, we propose a spectroscopy experiment to precisely measure the most important parameter controlling the location of the phase boundary.

cond-mat.str-el↗