Publications

Order by: publication date number of citations

• The ITensor Software Library for Tensor Network Calculations

  Matthew Fishman, Steven R. White, E. Miles Stoudenmire

  SciPost Phys. Codebases 4 (2022) · published 23 August 2022 | Toggle abstract · pdf

  ITensor is a system for programming tensor network calculations with an interface modeled on tensor diagram notation, which allows users to focus on the connectivity of a tensor network without manually bookkeeping tensor indices. The ITensor interface rules out common programming errors and enables rapid prototyping of tensor network algorithms. After discussing the philosophy behind the ITensor approach, we show examples of each part of the interface including Index objects, the ITensor product operator, tensor factorizations, tensor storage types, algorithms for matrix product state (MPS) and matrix product operator (MPO) tensor networks, quantum number conserving block-sparse tensors, and the NDTensors library. We also review publications that have used ITensor for quantum many-body physics and for other areas where tensor networks are increasingly applied. To conclude we discuss promising features and optimizations to be added in the future.

  221 citations

• Reproducing topological properties with quasi-Majorana states

  Adriaan Vuik, Bas Nijholt, Anton R. Akhmerov, Michael Wimmer

  SciPost Phys. 7, 061 (2019) · published 12 November 2019 | Toggle abstract · pdf

  Andreev bound states in hybrid superconductor-semiconductor devices can have near-zero energy in the topologically trivial regime as long as the confinement potential is sufficiently smooth. These quasi-Majorana states show zero-bias conductance features in a topologically trivial phase, mimicking spatially separated topological Majorana states. We show that in addition to the suppressed coupling between the quasi-Majorana states, also the coupling of these states across a tunnel barrier to the outside is exponentially different for increasing magnetic field. As a consequence, quasi-Majorana states mimic most of the proposed Majorana signatures: quantized zero-bias peaks, the $4\pi$ Josephson effect, and the tunneling spectrum in presence of a normal quantum dot. We identify a quantized conductance dip instead of a peak in the open regime as a distinguishing feature of true Majorana states in addition to having a bulk topological transition. Because braiding schemes rely only on the ability to couple to individual Majorana states, the exponential control over coupling strengths allows to also use quasi-Majorana states for braiding. Therefore, while the appearance of quasi-Majorana states complicates the observation of topological Majorana states, it opens an alternative route towards braiding of non-Abelian anyons and protected quantum computation.

  163 citations

• Entanglement spectrum and symmetries in non-Hermitian fermionic non-interacting models

  Loïc Herviou, Nicolas Regnault, Jens H. Bardarson

  SciPost Phys. 7, 069 (2019) · published 28 November 2019 | Toggle abstract · pdf

  We study the properties of the entanglement spectrum in gapped non-interacting non-Hermitian systems, and its relation to the topological properties of the system Hamiltonian. Two different families of entanglement Hamiltonians can be defined in non-Hermitian systems, depending on whether we consider only right (or equivalently only left) eigenstates or a combination of both left and right eigenstates. We show that their entanglement spectra can still be computed efficiently, as in the Hermitian limit. We discuss how symmetries of the Hamiltonian map into symmetries of the entanglement spectrum depending on the choice of the many-body state. Through several examples in one and two dimensions, we show that the biorthogonal entanglement Hamiltonian directly inherits the topological properties of the Hamiltonian for line gapped phases, with characteristic singular and energy zero modes. The right (left) density matrix carries distinct information on the topological properties of the many-body right (left) eigenstates themselves. In purely point gapped phases, when the energy bands are not separable, the relation between the entanglement Hamiltonian and the system Hamiltonian breaks down.

  65 citations

• Multifractality and its role in anomalous transport in the disordered XXZ spin-chain

  David J. Luitz, Ivan M. Khaymovich, Yevgeny Bar Lev

  SciPost Phys. Core 2, 006 (2020) · published 30 April 2020 | Toggle abstract · pdf

  The disordered XXZ model is a prototype model of the many-body localization transition (MBL). Despite numerous studies of this model, the available numerical evidence of multifractality of its eigenstates is not very conclusive due severe finite size effects. Moreover it is not clear if similarly to the case of single-particle physics, multifractal properties of the many-body eigenstates are related to anomalous transport, which is observed in this model. In this work, using a state-of-the-art, massively parallel, numerically exact method, we study systems of up to 24 spins and show that a large fraction of the delocalized phase flows towards ergodicity in the thermodynamic limit, while a region immediately preceding the MBL transition appears to be multifractal in this limit. We discuss the implication of our finding on the mechanism of subdiffusive transport.

  51 citations

• Codebase release 0.3 for ITensor

  Matthew Fishman, Steven R. White, E. Miles Stoudenmire

  SciPost Phys. Codebases 4-r0.3 (2022) · published 23 August 2022 | Toggle abstract · src

  ITensor is a system for programming tensor network calculations with an interface modeled on tensor diagram notation, which allows users to focus on the connectivity of a tensor network without manually bookkeeping tensor indices. The ITensor interface rules out common programming errors and enables rapid prototyping of tensor network algorithms. After discussing the philosophy behind the ITensor approach, we show examples of each part of the interface including Index objects, the ITensor product operator, tensor factorizations, tensor storage types, algorithms for matrix product state (MPS) and matrix product operator (MPO) tensor networks, quantum number conserving block-sparse tensors, and the NDTensors library. We also review publications that have used ITensor for quantum many-body physics and for other areas where tensor networks are increasingly applied. To conclude we discuss promising features and optimizations to be added in the future.

  40 citations

• Learning the ground state of a non-stoquastic quantum Hamiltonian in a rugged neural network landscape

  Marin Bukov, Markus Schmitt, Maxime Dupont

  SciPost Phys. 10, 147 (2021) · published 17 June 2021 | Toggle abstract · pdf

  Strongly interacting quantum systems described by non-stoquastic Hamiltonians exhibit rich low-temperature physics. Yet, their study poses a formidable challenge, even for state-of-the-art numerical techniques. Here, we investigate systematically the performance of a class of universal variational wave-functions based on artificial neural networks, by considering the frustrated spin-$1/2$ $J_1-J_2$ Heisenberg model on the square lattice. Focusing on neural network architectures without physics-informed input, we argue in favor of using an ansatz consisting of two decoupled real-valued networks, one for the amplitude and the other for the phase of the variational wavefunction. By introducing concrete mitigation strategies against inherent numerical instabilities in the stochastic reconfiguration algorithm we obtain a variational energy comparable to that reported recently with neural networks that incorporate knowledge about the physical system. Through a detailed analysis of the individual components of the algorithm, we conclude that the rugged nature of the energy landscape constitutes the major obstacle in finding a satisfactory approximation to the ground state wavefunction, and prevents learning the correct sign structure. In particular, we show that in the present setup the neural network expressivity and Monte Carlo sampling are not primary limiting factors.

  38 citations

• Investigation of the Néel phase of the frustrated Heisenberg antiferromagnet by differentiable symmetric tensor networks

  Juraj Hasik, Didier Poilblanc, Federico Becca

  SciPost Phys. 10, 012 (2021) · published 20 January 2021 | Toggle abstract · pdf

  The recent progress in the optimization of two-dimensional tensor networks [H.-J. Liao, J.-G. Liu, L. Wang, and T. Xiang, Phys. Rev. X 9, 031041 (2019)] based on automatic differentiation opened the way towards precise and fast optimization of such states and, in particular, infinite projected entangled-pair states (iPEPS) that constitute a generic-purpose Ansatz for lattice problems governed by local Hamiltonians. In this work, we perform an extensive study of a paradigmatic model of frustrated magnetism, the J 1 − J 2 Heisenberg an- tiferromagnet on the square lattice. By using advances in both optimization and subsequent data analysis, through finite correlation-length scaling, we re- port accurate estimations of the magnetization curve in the Néel phase for J 2 /J 1 ≤ 0.45. The unrestricted iPEPS simulations reveal an U (1) symmetric structure, which we identify and impose on tensors, resulting in a clean and consistent picture of antiferromagnetic order vanishing at the phase transition with a quantum paramagnet at J 2 /J 1 ≈ 0.46(1). The present methodology can be extended beyond this model to study generic order-to-disorder transitions in magnetic systems.

  31 citations

• Riemannian optimization of isometric tensor networks

  Markus Hauru, Maarten Van Damme, Jutho Haegeman

  SciPost Phys. 10, 040 (2021) · published 17 February 2021 | Toggle abstract · pdf

  Several tensor networks are built of isometric tensors, i.e. tensors satisfying $W^\dagger W = \mathrm{I}$. Prominent examples include matrix product states (MPS) in canonical form, the multiscale entanglement renormalization ansatz (MERA), and quantum circuits in general, such as those needed in state preparation and quantum variational eigensolvers. We show how gradient-based optimization methods on Riemannian manifolds can be used to optimize tensor networks of isometries to represent e.g. ground states of 1D quantum Hamiltonians. We discuss the geometry of Grassmann and Stiefel manifolds, the Riemannian manifolds of isometric tensors, and review how state-of-the-art optimization methods like nonlinear conjugate gradient and quasi-Newton algorithms can be implemented in this context. We apply these methods in the context of infinite MPS and MERA, and show benchmark results in which they outperform the best previously-known optimization methods, which are tailor-made for those specific variational classes. We also provide open-source implementations of our algorithms.

  31 citations

• NetKet 3: Machine Learning Toolbox for Many-Body Quantum Systems

  Filippo Vicentini, Damian Hofmann, Attila Szabó, Dian Wu, Christopher Roth, Clemens Giuliani, Gabriel Pescia, Jannes Nys, Vladimir Vargas-Calderón, Nikita Astrakhantsev, Giuseppe Carleo

  SciPost Phys. Codebases 7 (2022) · published 24 August 2022 | Toggle abstract · pdf

  We introduce version 3 of NetKet, the machine learning toolbox for many-body quantum physics. NetKet is built around neural-network quantum states and provides efficient algorithms for their evaluation and optimization. This new version is built on top of JAX, a differentiable programming and accelerated linear algebra framework for the Python programming language. The most significant new feature is the possibility to define arbitrary neural network ansätze in pure Python code using the concise notation of machine-learning frameworks, which allows for just-in-time compilation as well as the implicit generation of gradients thanks to automatic differentiation. NetKet 3 also comes with support for GPU and TPU accelerators, advanced support for discrete symmetry groups, chunking to scale up to thousands of degrees of freedom, drivers for quantum dynamics applications, and improved modularity, allowing users to use only parts of the toolbox as a foundation for their own code.

  31 citations

• Role of Sb in the superconducting kagome metal CsV$_3$Sb$_5$ revealed by its anisotropic compression

  Alexander A. Tsirlin, Pierre Fertey, Brenden R. Ortiz, Berina Klis, Valentino Merkl, Martin Dressel, Stephen D. Wilson, Ece Uykur

  SciPost Phys. 12, 049 (2022) · published 2 February 2022 | Toggle abstract · pdf

  Pressure evolution of the superconducting kagome metal CsV$_3$Sb$_5$ is studied with single-crystal x-ray diffraction and density-functional band-structure calculations. A highly anisotropic compression observed up to 5 GPa is ascribed to the fast shrinkage of the Cs-Sb distances and suppression of Cs rattling motion. This prevents Sb displacements required to stabilize the three-dimensional charge-density-wave (CDW) order and elucidates the disappearance of the CDW already at 2 GPa despite only minor changes in the electronic structure of the normal state. At higher pressures, vanadium bands still change only marginally, whereas antimony bands undergo a major reconstruction caused by the gradual formation of the interlayer Sb-Sb bonds. Our results exclude pressure tuning of vanadium kagome bands as the main mechanism for the non-trivial evolution of superconductivity in real-world kagome metals. Concurrently, we establish the central role of Sb atoms in the stabilization of a three-dimensional CDW and Fermi surface reconstruction.

  30 citations