arXiv subjects

Matthias Troyer

Publications and source records attributed to Matthias Troyer.

At least 73 records · Page 4Linked to original sources

arXiv2016

Multiferroic magnetic spirals induced by random magnetic exchanges

Multiferroism can originate from the breaking of inversion symmetry caused by magnetic-spiral order. The usual mechanism for stabilizing a magnetic spiral is competition between magnetic exchange interactions differing by their range and sign, such as nearest-neighbor and next-nearest- neighbor interactions. Since the latter are usually weak the onset temperatures for multiferroism via this mechanism are typically low. By considering a realistic model for YBaCuFeO$_5$ we propose an alternative mechanism for magnetic-spiral order, and hence for multiferroism, that occurs at much higher temperatures. We show using Monte-Carlo simulations and electronic structure calculations based on density functional theory that the Heisenberg model on a geometrically non-frustrated lattice with only nearest-neighbor interactions can have a spiral phase up to high temperature when frustrating bonds are introduced randomly along a single crystallographic direction as caused, e.g., by a particular type of chemical disorder. This long-range correlated pattern of frustration avoids ferroelectrically inactive spin glass order. Finally, we provide an intuitive explanation for this mechanism and discuss its generalization to other materials.

cond-mat.mtrl-sci↗

arXiv2016

On the impact of strain on the electronic properties of InAs/GaSb quantum well systems

Electron-hole hybridization in InAs/GaSb double quantum well structures leads to the formation of a mini band gap. We experimentally and theoretically studied the impact of strain on the transport properties of this material system. Thinned samples were mounted to piezo electric elements to exert strain along the [011] and [001] crystal directions. When the Fermi energy is tuned through the mini gap, a dramatic impact on the resistivity at the charge neutrality point is found which depends on the amount of applied external strain. In the electron and hole regimes, strain influences the Landau level structure. By analyzing the intrinsic strain from the epitaxial growth, the external strain from the piezo elements and combining our experimental results with numerical simulations of strained and unstrained quantum wells, we compellingly illustrate why the InAs/GaSb material system is regularly found to be semimetallic.

cond-mat.str-el↗

arXiv2016

High-Temperature Series Expansion for Spin-1/2 Heisenberg Models

We present a high-temperature series expansion code for spin-1/2 Heisenberg models on arbitrary lattices. As an example we demonstrate how to use the application for an anisotropic triangular lattice with two independent couplings J1 and J2 and calculate the high-temperature series of the magnetic susceptibility and the static structure factor up to 12th and 10th order, respectively. We show how to extract effective coupling constants for the triangular Heisenberg model from experimental data on Cs2CuBr4.

cond-mat.str-el↗

arXiv2016

The enigmatic 12/5 fractional quantum Hall effect

We numerically study the fractional quantum Hall effect at filling factors $ν=12/5$ and 13/5 (the particle-hole conjugate of 12/5) in high-quality two-dimensional GaAs heterostructures via exact diagonalization including finite well width and Landau level mixing. We find that Landau level mixing suppresses $ν=13/5$ fractional quantum Hall effect relative to $ν=12/5$. By contrast, we find both $ν=2/5$ and (its particle-hole conjugate) $ν=3/5$ fractional quantum Hall effects in the lowest Landau level to be robust under Landau level mixing and finite well-width corrections. Our results provide a possible explanation for the experimental absence of the 13/5 fractional quantum Hall state as caused by Landau level mixing effects.

cond-mat.str-el↗

arXiv2016

Accelerated nuclear quantum effects sampling with open path integrals

We numericaly demonstrate that, in double well models, the autocorrelation time of open path integral Monte Carlo simulations can be much smaller compared to standard ones using ring polymers. We also provide an intuitive explanation based on the role of instantons as transition states of the path integral pseudodynamics. Therefore we propose that, in all cases when the ground state approximation to the finite temperature partition function holds, open path integral simulations can be used to accelerate the sampling in realistic simulations aimed to explore nuclear quantum effects.

physics.comp-ph↗

arXiv2016

MoTe2: A Type-II Weyl Topological Metal

Based on the ab initio calculations, we show that MoTe2, in its low-temperature orthorhombic structure characterized by an X-ray diffraction study at 100 K, realizes 4 type-II Weyl points between the N-th and N+1-th bands, where N is the total number of valence electrons per unit cell. Other WPs and nodal lines between different other bands also appear close to the Fermi level due to a complex topological band structure. We predict a series of strain-driven topological phase transitions in this compound, opening a wide range of possible experimental realizations of different topological semimetal phases. Crucially, with no strain, the number of observable surface Fermi arcs in this material is 2 - the smallest number of arcs consistent with time-reversal symmetry.

cond-mat.mtrl-sci↗

arXiv2016

Density redistribution effects in fermionic optical lattices

We simulate a one dimensional fermionic optical lattice to analyse heating due to non-adiabatic lattice loading. Our simulations reveal that, similar to the bosonic case, density redistribution effects are the major cause of heating in harmonic traps. We suggest protocols to modulate the local density distribution during the process of lattice loading, in order to reduce the excess energy. Our numerical results confirm that linear interpolation of the trapping potential and/or the interaction strength is an efficient method of doing so, bearing practical applications relevant to experiments.

cond-mat.quant-gas↗

arXiv2016

Topological Phases in InAs$_{1-x}$Sb$_x$: From Novel Topological Semimetal to Majorana Wire

Superconductor proximitized one-dimensional semiconductor nanowires with strong spin-orbit interaction (SOI) are at this time the most promising candidates for the realization of topological quantum information processing. In current experiments the SOI originates predominantly from extrinsic fields, induced by finite size effects and applied gate voltages. The dependence of the topological transition in these devices on microscopic details makes scaling to a large number of devices difficult unless a material with dominant intrinsic bulk SOI is used. Here we show that wires made of certain ordered alloys InAs$_{1-x}$Sb$_x$ have spin-splittings up to 20 times larger than those reached in pristine InSb wires. In particular, we show this for a stable ordered CuPt-structure at $x = 0.5$, which has an inverted band ordering and realizes a novel type of a topological semimetal with triple degeneracy points in the bulk spectrum that produce topological surface Fermi arcs. Experimentally achievable strains can drive this compound either into a topological insulator phase, or restore the normal band ordering making the CuPt-ordered InAs$_{0.5}$Sb$_{0.5}$ a semiconductor with a large intrinsic linear in $k$ bulk spin splitting.

cond-mat.mes-hall↗

arXiv2016

Fulde-Ferrell-Larkin-Ovchinnikov pairing as leading instability on the square lattice

We study attractively interacting spin-1/2 fermions on the square lattice subject to a spin population imbalance. Using unbiased diagrammatic Monte Carlo simulations we find an extended region in the parameter space where the Fermi liquid is unstable towards formation of Cooper pairs with non-zero center-of-mass momentum, known as the Fulde-Ferrell-Larkin-Ovchinnikov (FFLO) state. In contrast to earlier mean-field and quasi-classical studies we provide quantitative and well-controlled predictions on the existence and location of the relevant Fermi-liquid instabilities. The highest temperature where the FFLO instability can be observed is about half of the superfluid transition temperature in the unpolarized system.

cond-mat.supr-con↗

arXiv2016

Bind: a Partitioned Global Workflow Parallel Programming Model

High Performance Computing is notorious for its long and expensive software development cycle. To address this challenge, we present Bind: a "partitioned global workflow" parallel programming model for C++ applications that enables quick prototyping and agile development cycles for high performance computing software targeting heterogeneous distributed many-core architectures. We present applications of Bind to Linear Algebra and MapReduce algorithms alongside with performance results.

cs.DC↗

arXiv2016

Solving the Quantum Many-Body Problem with Artificial Neural Networks

The challenge posed by the many-body problem in quantum physics originates from the difficulty of describing the non-trivial correlations encoded in the exponential complexity of the many-body wave function. Here we demonstrate that systematic machine learning of the wave function can reduce this complexity to a tractable computational form, for some notable cases of physical interest. We introduce a variational representation of quantum states based on artificial neural networks with variable number of hidden neurons. A reinforcement-learning scheme is then demonstrated, capable of either finding the ground-state or describing the unitary time evolution of complex interacting quantum systems. We show that this approach achieves very high accuracy in the description of equilibrium and dynamical properties of prototypical interacting spins models in both one and two dimensions, thus offering a new powerful tool to solve the quantum many-body problem.

cond-mat.dis-nn↗

arXiv2016

Local spin operators for fermion simulations

Digital quantum simulation of fermionic systems is important in the context of chemistry and physics. Simulating fermionic models on general purpose quantum computers requires imposing a fermionic algebra on spins. The previously studied Jordan-Wigner and Bravyi-Kitaev transformations are two techniques for accomplishing this task. Here we re-examine an auxiliary fermion construction which maps fermionic operators to local operators on spins. The local simulation is performed by relaxing the requirement that the number of spins should match the number of fermionic modes. Instead, auxiliary modes are introduced to enable non-consecutive fermionic couplings to be simulated with constant low-rank tensor products on spins. We connect the auxiliary fermion construction to other topological models and give examples of the construction.

quant-ph↗

arXiv2016

Elucidating Reaction Mechanisms on Quantum Computers

We show how a quantum computer can be employed to elucidate reaction mechanisms in complex chemical systems, using the open problem of biological nitrogen fixation in nitrogenase as an example. We discuss how quantum computers can augment classical-computer simulations for such problems, to significantly increase their accuracy and enable hitherto intractable simulations. Detailed resource estimates show that, even when taking into account the substantial overhead of quantum error correction, and the need to compile into discrete gate sets, the necessary computations can be performed in reasonable time on small quantum computers. This demonstrates that quantum computers will realistically be able to tackle important problems in chemistry that are both scientifically and economically significant.

quant-ph↗

arXiv2016

A Software Methodology for Compiling Quantum Programs

Quantum computers promise to transform our notions of computation by offering a completely new paradigm. To achieve scalable quantum computation, optimizing compilers and a corresponding software design flow will be essential. We present a software architecture for compiling quantum programs from a high-level language program to hardware-specific instructions. We describe the necessary layers of abstraction and their differences and similarities to classical layers of a computer-aided design flow. For each layer of the stack, we discuss the underlying methods for compilation and optimization. Our software methodology facilitates more rapid innovation among quantum algorithm designers, quantum hardware engineers, and experimentalists. It enables scalable compilation of complex quantum algorithms and can be targeted to any specific quantum hardware implementation.

cs.PL↗

arXiv2016

Topological phase transitions in the repulsively interacting Haldane-Hubbard model

Using dynamical mean-field theory and exact diagonalization we study the phase diagram of the repulsive Haldane-Hubbard model, varying the interaction strength and the sublattice potential difference. In addition to the quantum Hall phase with Chern number $C=2$ and the band insulator with $C=0$ present already in the noninteracting model, the system also exhibits a $C=0$ Mott insulating phase, and a $C=1$ quantum Hall phase. We explain the latter phase by a spontaneous symmetry breaking where one of the spin-components is in the Hall state and the other in the band insulating state.

cond-mat.quant-gas↗

arXiv2016

High Performance Emulation of Quantum Circuits

As quantum computers of non-trivial size become available in the near future, it is imperative to develop tools to emulate small quantum computers. This allows for validation and debugging of algorithms as well as exploring hardware-software co-design to guide the development of quantum hardware and architectures. The simulation of quantum computers entails multiplications of sparse matrices with very large dense vectors of dimension $2^n$, where $n$ denotes the number of qubits, making this a memory-bound and network bandwidth-limited application. We introduce the concept of a quantum computer \textit{emulator} as a component of a software framework for quantum computing, enabling a significant performance advantage over simulators by emulating quantum algorithms at a high level rather than simulating individual gate operations. We describe various optimization approaches and present benchmarking results, establishing the superiority of quantum computer emulators in terms of performance.

quant-ph↗

arXiv2016

Superfluidity and Density Order in a Bilayer Extended Hubbard Model

We use cluster dynamical mean field theory to study the phase diagram of the square lattice bilayer Hubbard model with an interlayer interaction. The layers are populated by two-component fermions, and the densities in both layers and the strength of the interactions are varied. We find that an attractive interlayer interaction can induce a checkerboard density ordered phase and superfluid phases, with either interlayer or intralayer pairing. Remarkably, the latter phase does not require an intralayer interaction to be present: it can be attributed to an induced attractive interaction caused by density fluctuations in the other layer.

cond-mat.quant-gas↗

arXiv2016

First order topological phase transition of the Haldane--Hubbard model

We study the interplay of topological band structure and conventional magnetic long-range order in spinful Haldane model with onsite repulsive interaction. Using the dynamical cluster approximation with clusters of up to 24 sites we find evidence of a first order phase transition from a Chern insulator at weak coupling to a topologically trivial antiferromagnetic insulator at strong coupling. These results call into question a previously found intermediate state with coexisting topological character and antiferromagnetic long-range order. Experimentally measurable signatures of the first order transition include hysteretic behavior of the double occupancy, single-particle excitation gap and nearest neighbor spin-spin correlations. This first order transition is contrasted with a continuous phase transition from the conventional band insulator to the antiferromagnetic insulator in the ionic Hubbard model on the honeycomb lattice.

cond-mat.str-el↗