Tensor network algorithms seek to minimize correlations to compress the classical data representing quantum states. Tensor network algorithms and similar tools—called tensor network methods—form the backbone of modern numerical methods used to simulate many-body physics and have a further range of applications in machine learning. Finding and contracting tensor network states is a computational task, which may be accelerated by quantum computing. We present a quantum algorithm that returns a classical description of a rank-r tensor network state satisfying an area law and approximating an eigenvector given black-box access to a unitary matrix. Our work creates a bridge between several contemporary approaches, including tensor networks, the variational quantum eigensolver (VQE), quantum approximate optimization algorithm (QAOA), and quantum computation.
Tensor network algorithms seek to minimize correlations to compress the classical data representing quantum states. Tensor network algorithms and similar tools—called tensor network methods—form the backbone of modern numerical methods used to simulate many-body physics and have a further range of applications in machine learning. Finding and contracting tensor network states is a computational task, which may be accelerated by quantum computing. We present a quantum algorithm that returns a classical description of a rank-r tensor network state satisfying an area law and approximating an eigenvector given black-box access to a unitary matrix. Our work creates a bridge between several contemporary approaches, including tensor networks, the variational quantum eigensolver (VQE), quantum approximate optimization algorithm (QAOA), and quantum computation.
Matrix product states minimize bipartite correlations to compress the classical data representing quantum states. Matrix product state algorithms and similar tools---called tensor network methods---form the backbone of modern numerical methods used to simulate many-body physics. Matrix product states have a further range of applications in machine learning. Finding matrix product states is in general a computationally challenging task, a computational task which we show quantum computers can accelerate. We present a quantum algorithm which returns a classical description of a k-rank matrix product state approximating an eigenvector given black-box access to a unitary matrix. Each iteration of the optimization requires O(n⋅k2) quantum gates, yielding sufficient conditions for our quantum variational algorithm to terminate in polynomial-time.
Tensors are a natural generalization of matrices, and tensor networks are a natural generalization of matrix products. Despite the simple definition of tensor networks, they are versatile enough to represent many different kinds of "products" that arise in various theoretical and practical problems. In particular, the powerful computational model of quantum computation can be defined almost entirely in terms of matrix products and tensor products, both of which are special cases of tensor networks. As such, (classical) algorithms for evaluating tensor networks have profound importance in the study of quantum computation. In this thesis, we design and implement a parallel algorithm for tensor network contraction. In addition to finding efficient contraction orders for a tensor network, we also dynamically slice it into multiple sub-tasks with lower space and time costs, in order to evaluate the tensor network in parallel. We refer to such an evaluation strategy as a contraction scheme for the tensor network. In addition, we introduce a local optimization procedure that improves the efficiency of the contraction schemes we find. We also investigate the applications of our parallel tensor network contraction algorithm in quantum computation. The most ready application is the simulation of random quantum supremacy circuits, where we benchmark our algorithm to demonstrate its advantage over other similar tensor network based simulators. Other applications we found include evaluating the energy function of a Quantum Approximate Optimization Algorithm (QAOA), and simulating surface codes under a realistic error model with crosstalk.
Tensor network states are ubiquitous in the investigation of quantum many-body (QMB) physics. Their advantage over other state representations is evident from their reduction in the computational complexity required to obtain various quantities of interest, namely observables. Additionally, they provide a natural platform for investigating entanglement properties within a system. In this dissertation, we develop various novel algorithms and optimizations to tensor networks for the investigation of QMB systems, including classical and quantum circuits. Specifically, we study optimizations for the two-dimensional Ising model in a transverse field, we create an algorithm for the k-SAT problem, and we study the entanglement properties of random unitary circuits. In addition to these applications, we reinterpret renormalization group principles from QMB physics in the context of machine learning to develop a novel algorithm for the tasks of classification and regression, and then utilize machine learning architectures for the time evolution of operators in QMB systems.
In optimization, one of the well-known classical algorithms is power iterations. Simply stated, the algorithm recovers the dominant eigenvector of some diagonalizable matrix. Since numerous optimization problems can be formulated as an eigenvalue/eigenvector search, this algorithm features wide applicability. Operationally, power iterations consist of performing repeated matrix-to-vector multiplications (or MatVec) followed by a renormilization step in order to converge to the dominant eigenvalue/eigenvector. However, classical realizations, including novel tensor network based approaches, necessitate an exponential scaling for the algorithm's run-time. In this paper, we propose a quantum realiziation to circumvent this pitfall. Our methodology involves casting low-rank representations; Matrix Product Operators (MPO) for matrices and Matrix Product States (MPS) for vectors, into quantum circuits. Specifically, we recover a unitary approximation by variationally minimizing the Frobenius distance between a target MPO and an MPO ansatz wherein the tensor cores are constrained to unitaries. Such an unitary MPO can easily be implemented as a quantum circuit with the addition of ancillary qubits. Thereafter, with appropriate initialization and post-selection on the ancillary space, we realize a single iteration of the classical algorithm. With our proposed methodology, power iterations can be realized entirely on a quantum computer via repeated, static circuit blocks; therefore, a run-time advantage can indeed be guaranteed. Moreover, by exploiting Riemannian optimization and cross-approximation techniques, our methodology becomes instance agnostic and thus allows one to address black-box optimization within the framework of quantum computing.
Tensor networks can compactly represent high-dimensional data in the form of low-rank tensor decompositions, which helps capture complex structures and correlations within the data. However, their inherently multilinear nature limits their potential as universal approximators. To address this limitation, tensor networks are combined with classical neural network layers, introducing nonlinear elements to enhance the model’s expressive power. The Hybrid Tensor Networks (HTN) system encompasses two prevalent tensor network configurations, Matrix Product States and Tree Tensor Networks, which facilitates the adaptable design of models customized for particular machine learning applications. This framework has been validated on classification and image reconstruction tasks, demonstrating its potential to handle complex data structures and its applicability within the machine learning field. Employing this approach, the goal is to establish a foundation for future research on hybrid quantum-classical models, thereby opening up avenues for the realm of quantum machine learning.
The convergence of machine learning (ML) and quantum computing is quickly becoming a game-changing new frontier in computational science. The most intriguing area of overlap may be quantum optimization, which seeks to reduce the exponentially increasing complexity and computational cost of ML algorithms. As they grow larger and more complicated, traditional optimization methods, particularly in high-dimensional and non-convex space, will inevitably hit performance limits. Quantum optimization is the whole new paradigm that leverages quantum mechanical effects like superposition, entanglement, and tunnelling to explore solution spaces more efficiently. The chapter outlines the theory, practice, and potential of hybrid quantum-classical optimization algorithms for machine learning. The most brilliant research direction in the current NISQ (noisy intermediate-scale quantum) era is mixed systems leveraging classical computing capability augmented by quantum capacity. In such designs, computationally intensive subroutines like optimization for global optima or escape from local minima are left to quantum processors and data preprocessing, iterative refinement, and model testing are performed by classical processors. We start by defining the fundamental principles of quantum computing and acquainting readers with the fundamentals like qubits, quantum gates, and quantum circuits. These are the building blocks for quantum algorithms, which hopefully can be utilized for optimization, for example, the QAOA (quantum approximate optimization algorithm), the VQE (variational quantum Eigensolver), and quantum annealing. They all build to optimize the problems in some way differently: QAOA through parameterized quantum circuits, VQE through approximations of ground states of the Hamiltonians, and quantum annealing through quantum evolution to low-energy solutions. We then form a loop between these quantum algorithms and regular machine learning tasks. Optimization impacts virtually all ML phases, from training neural networks, where one reduces loss functions; feature selection, where one aims to discover the most relevant subset of input variables; and hyperparameter optimization, which often involves expensive search procedures over extremely large combinatorial spaces. Quantum optimization techniques can therefore, in principle, accelerate such procedures through computational complexity reduction and enhancing solutions over challenging landscapes. Realistic simulations and case studies emphasize the degree to which hybrid quantum-classical algorithms have been employed in solving ML problems, that is, QSVMs, quantum-enhanced clustering, and quantum reinforcement learning. Despite their experimental nature, these applications already show encouraging results in terms of improved performance metrics as well as reduction in time-to-solution compared to classical-only solutions. Notwithstanding that, this new field is not bereft of real challenges. Quantum hardware suffers from hard limits on qubit fidelity, decoherence, and scalability in the current times. Furthermore, quantum circuit integration into broad ML pipelines requires novel architectures and software platforms. As a counter to those issues, this chapter surveys recent advances in quantum programming languages, simulators, and hybrid platforms like PennyLane, Qiskit, and TensorFlow Quantum. We conclude by looking to the future possibility that quantum optimization will revolutionize the machine learning landscape. As hardware improves and algorithmic complexity increases, the possibility of quantum-powered learning systems solving hard problems becomes increasingly accessible. From speeding up deep network training to enabling new types of unsupervised learning, quantum optimization holds the potential to recast computational tractability in machine learning. This chapter is an all-encompassing introduction and state-of-the-art work for students, researchers, and practitioners interested in using quantum optimization for practical ML applications. It sets the foundation for understanding how to pursue hybrid approaches (how they may be applied today in the real world and bracing oneself for disruption in the future).