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arXiv:2407.17659

Discretized Quantum Exhaustive Search for Variational Quantum Algorithms

Ittay Alfassi, Dekel Meirom, Tal Mor

Published Jul 24, 2024• 0 citations
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Abstract

Quantum computers promise a great computational advantage over classical computers, yet currently available quantum devices have only a limited amount of qubits and a high level of noise, limiting the size of problems that can be solved accurately with those devices. Variational Quantum Algorithms (VQAs) have emerged as a leading strategy to address these limitations by optimizing cost functions based on measurement results of shallow-depth circuits. However, the optimization process usually suffers from severe trainability issues as a result of the exponentially large search space, mainly local minima and barren plateaus. Here we propose a novel method that can improve variational quantum algorithms -- ``discretized quantum exhaustive search''. On classical computers, exhaustive search, also named brute force, solves small-size NP complete and NP hard problems. Exhaustive search and efficient partial exhaustive search help designing heuristics and exact algorithms for solving larger-size problems by finding easy subcases or good approximations. We adopt this method to the quantum domain, by relying on mutually unbiased bases for the $2^n$-dimensional Hilbert space. We define a discretized quantum exhaustive search that works well for small size problems. We provide an example of an efficient partial discretized quantum exhaustive search for larger-size problems, in order to extend classical tools to the quantum computing domain, for near future and far future goals. Our method enables obtaining intuition on NP-complete and NP-hard problems as well as on Quantum Merlin Arthur (QMA)-complete and QMA-hard problems. We demonstrate our ideas in many simple cases, providing the energy landscape for various problems and presenting two types of energy curves via VQAs.

DOI
10.48550/arxiv.2407.17659

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Variational Quantum Algorithms (VQAs), such as the Quantum Approximate Optimization Algorithm (QAOA) of [Farhi, Goldstone, Gutmann, 2014], have seen intense study towards near-term applications on quantum hardware. A crucial parameter for VQAs is the \emph{depth} of the variational ``ansatz'' used -- the smaller the depth, the more amenable the ansatz is to near-term quantum hardware in that it gives the circuit a chance to be fully executed before the system decoheres. In this work, we show that approximating the optimal depth for a given VQA ansatz is intractable. Formally, we show that for any constant ε>0ε>0ε>0, it is QCMA-hard to approximate the optimal depth of a VQA ansatz within multiplicative factor N1−εN^{1-ε}N1−ε, for NNN denoting the encoding size of the VQA instance. (Here, Quantum Classical Merlin-Arthur (QCMA) is a quantum generalization of NP.) We then show that this hardness persists in the even ``simpler'' QAOA-type settings. To our knowledge, this yields the first natural QCMA-hard-to-approximate problems.
Variational Quantum Algorithms (VQAs), such as the Quantum Approximate Optimization Algorithm (QAOA) of [Farhi, Goldstone, Gutmann, 2014], have seen intense study towards near-term applications on quantum hardware. A crucial parameter for VQAs is the depth of the variational ansatz used - the smaller the depth, the more amenable the ansatz is to near-term quantum hardware in that it gives the circuit a chance to be fully executed before the system decoheres. In this work, we show that approximating the optimal depth for a given VQA ansatz is intractable. Formally, we show that for any constant ε > 0, it is QCMA-hard to approximate the optimal depth of a VQA ansatz within multiplicative factor N^(1-ε), for N denoting the encoding size of the VQA instance. (Here, Quantum Classical Merlin-Arthur (QCMA) is a quantum generalization of NP.) We then show that this hardness persists in the even "simpler" QAOA-type settings. To our knowledge, this yields the first natural QCMA-hard-to-approximate problems.
Variational quantum algorithms are proposed to solve relevant computational problems on near term quantum devices. Popular versions are variational quantum eigensolvers and quantum approximate optimization algorithms that solve ground state problems from quantum chemistry and binary optimization problems, respectively. They are based on the idea of using a classical computer to train a parametrized quantum circuit. We show that the corresponding classical optimization problems are NP-hard. Moreover, the hardness is robust in the sense that, for every polynomial time algorithm, there are instances for which the relative error resulting from the classical optimization problem can be arbitrarily large assuming that P≠NP. Even for classically tractable systems composed of only logarithmically many qubits or free fermions, we show the optimization to be NP-hard. This elucidates that the classical optimization is intrinsically hard and does not merely inherit the hardness from the ground state problem. Our analysis shows that the training landscape can have many far from optimal persistent local minima This means gradient and higher order descent algorithms will generally converge to far from optimal solutions.
Ising formulation is important for many NP problems (Lucas, 2014). This formulation enables implementing novel quantum computing methods including Quantum Approximate Optimization Algorithm and Variational Quantum Eigensolver (VQE). Here, we investigate closely the traveling salesman problem (TSP). First, we present some non-trivial issues related to Ising model view versus a realistic salesman. Then, focusing on VQE we discuss and clarify the use of: a.-- Conventional VQE and how it is relevant as a novel SAT-solver; b.-- Qubit efficiency and its importance in the Noisy Intermediate Scale Quantum-era; and c.-- the relevance and importance of a novel approach named Discrete Quantum Exhaustive Search (Alfassi, Meirom, and Mor, 2024), for enhancing VQE and other methods using mutually unbiased bases. The approach we present here in details can potentially be extended for analyzing approximating and solving various other NP complete problems. Our approach can also be extended beyond the Ising model and beyond the class NP, for example to the class Quantum Merlin Arthur (QMA) of problems, relevant for quantum chemistry and for general spin problems.
Exploring quantum applications of near-term quantum devices is a rapidly growing field of quantum information science with both theoretical and practical interests. A leading paradigm to establish such near-term quantum applications is variational quantum algorithms (VQAs). These algorithms use a classical optimizer to train a parameterized quantum circuit to accomplish certain tasks, where the circuits are usually randomly initialized. In this work, we prove that for a broad class of such random circuits, the variation range of the cost function via adjusting any local quantum gate within the circuit vanishes exponentially in the number of qubits with a high probability. This result can unify the restrictions on gradient-based and gradient-free optimizations in a natural manner and reveal extra harsh constraints on the training landscapes of VQAs. Hence a fundamental limitation on the trainability of VQAs is unraveled, indicating the essential mechanism of the optimization hardness in the Hilbert space with exponential dimension. We further showcase the validity of our results with numerical simulations of representative VQAs. We believe that these results would deepen our understanding of the scalability of VQAs and shed light on the search for near-term quantum applications with advantages.
Quantum variational algorithms (VQAs) are highly promising to realize quantum advantages on near-term quantum devices. Existing VQAs based on a manually fixed quantum are computationally inefficient due to noise and the limited coupling maps of these devices. Previous work considers various quantum architecture search (QAS) algorithms to autodesign a quantum based on specific questions to improve the performance of VQAs. Compared to manual design, autodesign can more efficiently explore the large space of a possible and achieve better performance. However, two main challenges in utilizing QAS to design quantum circuits efficiently are the tremendous amount of space required for candidate quantum circuits, and the disconnection between quantum devices and autodesign in terms of qubit mapping and quantum noise. To address these issues, we propose an adaptive diversity-based quantum search algorithm to efficiently generate the optimal quantum circuit based on device qubit mapping and noise. By considering the diversity among different candidate circuits and adaptively adding circuit depths, our approach only needs to focus on a small optimization space at each iteration step. In addition, the synchronization of optimizing circuit structure and aligning qubit mapping enables us to generate quantum circuits while avoiding additional mapping overhead. We evaluate the performance of our algorithm on simulators and real quantum devices for quantum eigenvalue problems and classification tasks. Results demonstrate that quantum circuits generated by our method outperform both a fixed hardware-efficient and randomly generated quantum circuits in terms of final performance and resource-saving. Our algorithm provides a flexible way to efficiently generate excellent quantum circuits for significantly improving the performances of VQAs on near-term quantum devices. Published by the American Physical Society 2024