122 research outputs found

    PyProp - A Python Framework for Propagating the Time Dependent Schrödinger Equation

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    A Brief Review on Mathematical Tools Applicable to Quantum Computing for Modelling and Optimization Problems in Engineering

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    Since its emergence, quantum computing has enabled a wide spectrum of new possibilities and advantages, including its efficiency in accelerating computational processes exponentially. This has directed much research towards completely novel ways of solving a wide variety of engineering problems, especially through describing quantum versions of many mathematical tools such as Fourier and Laplace transforms, differential equations, systems of linear equations, and optimization techniques, among others. Exploration and development in this direction will revolutionize the world of engineering. In this manuscript, we review the state of the art of these emerging techniques from the perspective of quantum computer development and performance optimization, with a focus on the most common mathematical tools that support engineering applications. This review focuses on the application of these mathematical tools to quantum computer development and performance improvement/optimization. It also identifies the challenges and limitations related to the exploitation of quantum computing and outlines the main opportunities for future contributions. This review aims at offering a valuable reference for researchers in fields of engineering that are likely to turn to quantum computing for solutions. Doi: 10.28991/ESJ-2023-07-01-020 Full Text: PD

    CoLA: Exploiting Compositional Structure for Automatic and Efficient Numerical Linear Algebra

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    Many areas of machine learning and science involve large linear algebra problems, such as eigendecompositions, solving linear systems, computing matrix exponentials, and trace estimation. The matrices involved often have Kronecker, convolutional, block diagonal, sum, or product structure. In this paper, we propose a simple but general framework for large-scale linear algebra problems in machine learning, named CoLA (Compositional Linear Algebra). By combining a linear operator abstraction with compositional dispatch rules, CoLA automatically constructs memory and runtime efficient numerical algorithms. Moreover, CoLA provides memory efficient automatic differentiation, low precision computation, and GPU acceleration in both JAX and PyTorch, while also accommodating new objects, operations, and rules in downstream packages via multiple dispatch. CoLA can accelerate many algebraic operations, while making it easy to prototype matrix structures and algorithms, providing an appealing drop-in tool for virtually any computational effort that requires linear algebra. We showcase its efficacy across a broad range of applications, including partial differential equations, Gaussian processes, equivariant model construction, and unsupervised learning.Comment: Code available at https://github.com/wilson-labs/col

    Massively parallel split-step Fourier techniques for simulating quantum systems on graphics processing units

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    The split-step Fourier method is a powerful technique for solving partial differential equations and simulating ultracold atomic systems of various forms. In this body of work, we focus on several variations of this method to allow for simulations of one, two, and three-dimensional quantum systems, along with several notable methods for controlling these systems. In particular, we use quantum optimal control and shortcuts to adiabaticity to study the non-adiabatic generation of superposition states in strongly correlated one-dimensional systems, analyze chaotic vortex trajectories in two dimensions by using rotation and phase imprinting methods, and create stable, threedimensional vortex structures in Bose–Einstein condensates through artificial magnetic fields generated by the evanescent field of an optical nanofiber. We also discuss algorithmic optimizations for implementing the split-step Fourier method on graphics processing units. All computational methods present in this work are demonstrated on physical systems and have been incorporated into a state-of-the-art and open-source software suite known as GPUE, which is currently the fastest quantum simulator of its kind.Okinawa Institute of Science and Technology Graduate Universit
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