The PageRank algorithm is used to rank web pages by their importance. Since its development, the PageRank algorithm is a critical and fundamental part of search engines today. PageRank is a graph-based algorithm that ranks pages based on how many other pages link to them. This work develops a variational quantum version of the PageRank algorithm and compares the performance of the two algorithms. It is found that quantum PageRank performs better at ranking websites than the normal PageRank algorithm
The quantization of the PageRank algorithm is a promising tool for a future quantum internet. Here we present a modification of the quantum PageRank introducing arbitrary phase rotations (APR) in the underlying Szegedy's quantum walk. We define three different APR schemes with only one phase as a degree of freedom. We have analyzed the behavior of these algorithms in a small generic graph, observing that a decrease of the phase reduces the standard deviation of the instantaneous PageRank, so the nodes of the network can be distinguished better. However, the algorithm takes more time to converg…
Google PageRank is a prevalent and useful algorithm for ranking the significance of nodes or websites in a network, and a recent quantum counterpart for PageRank algorithm has been raised to suggest a higher accuracy of ranking comparing to Google PageRank. The quantum PageRank algorithm is essentially based on quantum stochastic walks and can be expressed using Lindblad master equation, which, however, needs to solve the Kronecker products of an O(N^4) dimension and requires severely large memory and time when the number of nodes N in a network increases above 150. Here, we present an efficie…
Four new centrality measures for directed networks based on unitary, continuous-time quantum walks (CTQW) in $n$ dimensions -- where $n$ is the number of nodes -- are presented, tested and discussed. The main idea behind these methods consists in re-casting the classical HITS and PageRank algorithms as eigenvector problems for symmetric matrices, and using these symmetric matrices as Hamiltonians for CTQWs, in order to obtain a unitary evolution operator. The choice of the initial state is also crucial. Two options were tested: a vector with uniform occupation and a vector weighted w.r.t.~in- …
We analyze a binary classification problem by using a support vector machine based on variational quantum-circuit model. We propose to solve a linear equation of the support vector machine by using a $Γ$ matrix expansion. In addition, it is shown that an arbitrary quantum state is prepared by optimizing a universal quantum circuit representing an arbitrary $U(2^N)$ based on the steepest descent method. It may be a quantum generalization of Field-Programmable-Gate Array (FPGA).
Variational Quantum Algorithms are among the most promising systems to implement quantum computing under the Noisy-Intermediate Scale Quantum (NISQ) technology. In variational quantum algorithm, wavefunction represented by a parametrized ansatz and variational parameters are updated iteratively with a classical computer based on the measurement outputs from the quantum computer. In this paper, we investigate perturbation theory with these algorithms and prospect the possibility of using the variational quantum algorithm to simulate quantum dynamics in perturbation theory. We illustrate the use…
Variational quantum algorithms have been proposed to solve static and dynamic problems of closed many-body quantum systems. Here we investigate variational quantum simulation of three general types of tasks---generalised time evolution with a non-Hermitian Hamiltonian, linear algebra problems, and open quantum system dynamics. The algorithm for generalised time evolution provides a unified framework for variational quantum simulation. In particular, we show its application in solving linear systems of equations and matrix-vector multiplications by converting these algebraic problems into gener…
We propose a hybrid quantum-classical approach to model continuous classical probability distributions using a variational quantum circuit. The architecture of the variational circuit consists of two parts: a quantum circuit employed to encode a classical random variable into a quantum state, called the quantum encoder, and a variational circuit whose parameters are optimized to mimic a target probability distribution. Samples are generated by measuring the expectation values of a set of operators chosen at the beginning of the calculation. Our quantum generator can be complemented with a clas…
The geometric measure of entanglement of variational quantum states is studied on the basis of its relation with the mean value of spin. We examine n-qubit quantum states prepared by a variational circuit with a layer formed by the rotational gates and two-qubit controlled phase gates. The variational circuit is a generalization of that used for preparing quantum Generative Adversarial Network states. The entanglement of a qubit with other qubits in the variational quantum states is determined by the angles of rotational gates that act on the qubit and qubits entangled with it by controlled ph…
The variational method is a versatile tool for classical simulation of a variety of quantum systems. Great efforts have recently been devoted to its extension to quantum computing for efficiently solving static many-body problems and simulating real and imaginary time dynamics. In this work, we first review the conventional variational principles, including the Rayleigh-Ritz method for solving static problems, and the Dirac and Frenkel variational principle, the McLachlan's variational principle, and the time-dependent variational principle, for simulating real time dynamics. We focus on the s…
Optimizing open quantum system evolution is an important step on the way to achieving quantum computing and quantum thermodynamic tasks. In this article, we approach optimisation via variational principles and derive an open quantum system variational algorithm explicitly for Lindblad evolution in Liouville space. As an example of such control over open system evolution, we control the thermalisation of a qubit attached to a thermal Lindbladian bath with a damping rate $γ$. Since thermalisation is an asymptotic process and the variational algorithm we consider is for fixed time, we present a w…
We propose to perform amplitude estimation with the help of constant-depth quantum circuits that variationally approximate states during amplitude amplification. In the context of Monte Carlo (MC) integration, we numerically show that shallow circuits can accurately approximate many amplitude amplification steps. We combine the variational approach with maximum likelihood amplitude estimation [Y. Suzuki et al., Quantum Inf. Process. 19, 75 (2020)] in variational quantum amplitude estimation (VQAE). VQAE typically has larger computational requirements than classical MC sampling. To reduce the v…
Subspace-Search Variational Quantum Eigen solver (SSVQE) is a searching method of multiple states and relies on the unitarity of transformations to ensure the orthogonality of output states for multiple states. Therefore, this method is thought to be a promising method for quantum chemistry because ordinary Variational Quantum Eigen solver (VQE) can only calculate the excited states step by step from the ground state based on Variational Quantum deflation (VQD). We compare the advantage of VQE, SSVQE with/without the constraint term and/or Tabu search term, which is added by the Lagrange multi…
The variational quantum eigensolver is a prominent hybrid quantum-classical algorithm expected to impact near-term quantum devices. They are usually based on a circuit ansatz consisting of parameterized single-qubit gates and fixed two-qubit gates. We study the effect of parameterized two-qubit gates in the variational quantum eigensolver. We simulate a variational quantum eigensolver algorithm using fixed and parameterized two-qubit gates in the circuit ansatz and show that the parameterized versions outperform the fixed versions, both when it comes to best energy and reducing outliers, for a…
Combinatorial optimization models a vast range of industrial processes aiming at improving their efficiency. In general, solving this type of problem exactly is computationally intractable. Therefore, practitioners rely on heuristic solution approaches. Variational quantum algorithms are optimization heuristics that can be demonstrated with available quantum hardware. In this case study, we apply four variational quantum heuristics running on IBM's superconducting quantum processors to the job shop scheduling problem. Our problem optimizes a steel manufacturing process. A comparison on 5 qubit…
Variational quantum algorithms have been one of the most intensively studied applications for near-term quantum computing applications. The noisy intermediate-scale quantum (NISQ) regime, where small enough algorithms can be run successfully on noisy quantum computers expected during the next 5 years, is driving both a large amount of research work and a significant amount of private sector funding. Therefore, it is important to understand whether variational algorithms are effective at successfully converging to the correct answer in presence of noise. We perform a comprehensive study of the …
Variational quantum algorithms dominate contemporary gate-based quantum enhanced optimisation, eigenvalue estimation and machine learning. Here we establish the quantum computational universality of variational quantum computation by developing two objective functions which minimise to prepare outputs of arbitrary quantum circuits. The fleeting resource of variational quantum computation is the number of expected values which must be iteratively minimised using classical-to-quantum outer loop optimisation. An efficient solution to this optimisation problem is given by the quantum circuit being…
Recently a new class of quantum algorithms that are based on the quantum computation of the connected moment expansion has been reported to find the ground and excited state energies. In particular, the Peeters-Devreese-Soldatov (PDS) formulation is found variational and bearing the potential for further combining with the existing variational quantum infrastructure. Here we find that the PDS formulation can be considered as a new energy functional of which the PDS energy gradient can be employed in a conventional variational quantum solver. In comparison with the usual variational quantum eig…
We propose the simulation of quantum-optical systems in the ultrastrong-coupling regime using a variational quantum algorithm. More precisely, we introduce a short-depth variational form to prepare the groundstate of the multimode Dicke model on a quantum processor and present proof-of-principle results obtained via cloud access to an IBM device. We moreover provide an algorithm for characterizing the groundstate by Wigner state tomography. Our work is a first step towards digital quantum simulation of quantum-optical systems with potential applications to the spin-boson, Kondo and Jahn-Teller…
We show that nonlinear problems including nonlinear partial differential equations can be efficiently solved by variational quantum computing. We achieve this by utilizing multiple copies of variational quantum states to treat nonlinearities efficiently and by introducing tensor networks as a programming paradigm. The key concepts of the algorithm are demonstrated for the nonlinear Schrödinger equation as a canonical example. We numerically show that the variational quantum ansatz can be exponentially more efficient than matrix product states and present experimental proof-of-principle results…
The variational quantum eigensolver (VQE) is a hybrid quantum-classical algorithm for finding the minimum eigenvalue of a Hamiltonian that involves the optimization of a parameterized quantum circuit. Since the resulting optimization problem is in general nonconvex, the method can converge to suboptimal parameter values which do not yield the minimum eigenvalue. In this work, we address this shortcoming by adopting the concept of variational adiabatic quantum computing (VAQC) as a procedure to improve VQE. In VAQC, the ground state of a continuously parameterized Hamiltonian is approximated vi…
Parameterized quantum circuits are a promising technology for achieving a quantum advantage. An important application is the variational simulation of time evolution of quantum systems. To make the most of quantum hardware, variational algorithms need to be as hardware-efficient as possible. Here we present alternatives to the time-dependent variational principle that are hardware-efficient and do not require matrix inversion. In relation to imaginary time evolution, our approach significantly reduces the hardware requirements. With regards to real time evolution, where high precision can be i…
Variational hybrid quantum-classical algorithms are some of the most promising workloads for near-term quantum computers without error correction. The aim of these variational algorithms is to guide the quantum system to a target state that minimizes a cost function, by varying certain parameters in a quantum circuit. This paper proposes a new approach for engineering cost functions to improve the performance of a certain class of these variational algorithms on today's small qubit systems. We apply this approach to a variational algorithm that generates thermofield double states of the transv…
The variational quantum eigensolver is a hybrid algorithm composed of quantum state driving and classical parameter optimization, for finding the ground state of a given Hamiltonian. The natural gradient method is an optimization method taking into account the geometric structure of the parameter space. Very recently, Stokes et al. developed the general method for employing the natural gradient for the variational quantum eigensolver. This paper gives some simple case-studies of this optimization method, to see in detail how the natural gradient optimizer makes use of the geometric property to…
Analysis of electron localization in a coupled quantum dot structure via variational approach: numerical results and application in quantum-dot cellular automata
Hybrid quantum-classical (HQC) algorithms make it possible to use near-term quantum devices supported by classical computational resources by useful control schemes. In this paper, we develop an HQC algorithm using an efficient variational optimization approach to simulate open system dynamics under the Noisy-Intermediate Scale Quantum(NISQ) computer. Using the time-dependent variational principle (TDVP) method and extending it to McLachlan TDVP for density matrix which involves minimization of Frobenius norm of the error, we apply the unitary quantum circuit to obtain the time evolution of th…
We employ spectral analysis and compressed sensing to identify settings where a variational algorithm's cost function can be recovered purely classically or with minimal quantum computer access. We present theoretical and numerical evidence supporting the viability of sparse recovery techniques. To demonstrate this approach, we use basis pursuit denoising to efficiently recover simulated Quantum Approximate Optimization Algorithm (QAOA) instances of large system size from very few samples. Our results indicate that sparse recovery can enable a more efficient use and distribution of quantum res…
Several quantities important in condensed matter physics, quantum information, and quantum chemistry, as well as quantities required in meta-optimization of machine learning algorithms, can be expressed as gradients of implicitly defined functions of the parameters characterizing the system. Here, we show how to leverage implicit differentiation for gradient computation through variational quantum algorithms and explore applications in condensed matter physics, quantum machine learning, and quantum information. A function defined implicitly as the solution of a quantum algorithm, e.g., a varia…
For the variational quantum eigensolver we propose to generate trial wavefunctions from a small amount of selected Pauli terms of the problem Hamiltonian. Two different approaches, one inspired by the quantum approximate optimization algorithm and the other by imaginary-time evolution, are proposed and studied in detail. Using numerical calculations, we study the efficiency of these trial wavefunctions for finding the ground-state energy of three molecules: H2, LiH and H2O. We find that only a small number of Pauli terms are needed to reach chemical accuracy, leading to short-depth quantum cir…
Variational hybrid quantum-classical algorithms (VHQCAs) are near-term algorithms that leverage classical optimization to minimize a cost function, which is efficiently evaluated on a quantum computer. Recently VHQCAs have been proposed for quantum compiling, where a target unitary $U$ is compiled into a short-depth gate sequence $V$. In this work, we report on a surprising form of noise resilience for these algorithms. Namely, we find one often learns the correct gate sequence $V$ (i.e., the correct variational parameters) despite various sources of incoherent noise acting during the cost-eva…
This work presents a novel realization approach to Quantum Boltzmann Machines (QBMs). The preparation of the required Gibbs states, as well as the evaluation of the loss function's analytic gradient is based on Variational Quantum Imaginary Time Evolution, a technique that is typically used for ground state computation. In contrast to existing methods, this implementation facilitates near-term compatible QBM training with gradients of the actual loss function for arbitrary parameterized Hamiltonians which do not necessarily have to be fully-visible but may also include hidden units. The variat…
