arXiv subjects

Yuri Alexeev

Publications and source records attributed to Yuri Alexeev.

At least 55 records · Page 3Linked to original sources

arXiv2023

Exploring Parameter Redundancy in the Unitary Coupled-Cluster Ansatze for Hybrid Variational Quantum Computing

One of the commonly used chemical-inspired approaches in variational quantum computing is the unitary coupled-cluster (UCC) ansatze. Despite being a systematic way of approaching the exact limit, the number of parameters in the standard UCC ansatze exhibits unfavorable scaling with respect to the system size, hindering its practical use on near-term quantum devices. Efforts have been taken to propose some variants of UCC ansatze with better scaling. In this paper we explore the parameter redundancy in the preparation of unitary coupled-cluster singles and doubles (UCCSD) ansatze employing spin-adapted formulation, small amplitude filtration, and entropy-based orbital selection approaches. Numerical results of using our approach on some small molecules have exhibited a significant cost reduction in the number of parameters to be optimized and in the time to convergence compared with conventional UCCSD-VQE simulations. We also discuss the potential application of some machine learning techniques in further exploring the parameter redundancy, providing a possible direction for future studies.

quant-ph↗

arXiv2023

Estimating the randomness of quantum circuit ensembles up to 50 qubits

Random quantum circuits have been utilized in the contexts of quantum supremacy demonstrations, variational quantum algorithms for chemistry and machine learning, and blackhole information. The ability of random circuits to approximate any random unitaries has consequences on their complexity, expressibility, and trainability. To study this property of random circuits, we develop numerical protocols for estimating the frame potential, the distance between a given ensemble and the exact randomness. Our tensor-network-based algorithm has polynomial complexity for shallow circuits and is high-performing using CPU and GPU parallelism. We study 1. local and parallel random circuits to verify the linear growth in complexity as stated by the Brown-Susskind conjecture, and; 2. hardware-efficient ansätze to shed light on its expressibility and the barren plateau problem in the context of variational algorithms. Our work shows that large-scale tensor network simulations could provide important hints toward open problems in quantum information science.

quant-ph↗

arXiv2022

QuYBE -- An Algebraic Compiler for Quantum Circuit Compression

QuYBE is an open-source algebraic compiler for the compression of quantum circuits. It has been applied for the efficient simulation of the Heisenberg Hamiltonian on quantum computers. Currently, it can simulate the time dynamics of one-dimensional chains. It includes modules to generate the quantum circuits for the above as well as produce the compressed circuits, which are independent of the time step. It utilizes the Yang-Baxter equation (YBE) to perform the compression. QuYBE enables users to seamlessly design, execute, and analyze the time dynamics of the Heisenberg Hamiltonian on quantum computers. QuYBE is the first step toward making the YBE technique available to a broader community of scientists from multiple domains. The QuYBE compiler is available at https://github.com/ZichangHe/QuYBE

quant-ph↗

arXiv2022

Embedding Learning in Hybrid Quantum-Classical Neural Networks

Quantum embedding learning is an important step in the application of quantum machine learning to classical data. In this paper we propose a quantum few-shot embedding learning paradigm, which learns embeddings useful for training downstream quantum machine learning tasks. Crucially, we identify the circuit bypass problem in hybrid neural networks, where learned classical parameters do not utilize the Hilbert space efficiently. We observe that the few-shot learned embeddings generalize to unseen classes and suffer less from the circuit bypass problem compared with other approaches.

quant-ph↗

arXiv2022

Stochastic Approach For Simulating Quantum Noise Using Tensor Networks

Noisy quantum simulation is challenging since one has to take into account the stochastic nature of the process. The dominating method for it is the density matrix approach. In this paper, we evaluate conditions for which this method is inferior to a substantially simpler way of simulation. Our approach uses stochastic ensembles of quantum circuits, where random Kraus operators are applied to original quantum gates to represent random errors for modeling quantum channels. We show that our stochastic simulation error is relatively low, even for large numbers of qubits. We implemented this approach as a part of the QTensor package. While usual density matrix simulations on average hardware are challenging at $n>15$, we show that for up to $n\lesssim 30$, it is possible to run embarrassingly parallel simulations with $<1\%$ error. By using the tensor slicing technique, we can simulate up to 100 qubit QAOA circuits with high depth using supercomputers.

quant-ph↗

arXiv2022

Constructing Optimal Contraction Trees for Tensor Network Quantum Circuit Simulation

One of the key problems in tensor network based quantum circuit simulation is the construction of a contraction tree which minimizes the cost of the simulation, where the cost can be expressed in the number of operations as a proxy for the simulation running time. This same problem arises in a variety of application areas, such as combinatorial scientific computing, marginalization in probabilistic graphical models, and solving constraint satisfaction problems. In this paper, we reduce the computationally hard portion of this problem to one of graph linear ordering, and demonstrate how existing approaches in this area can be utilized to achieve results up to several orders of magnitude better than existing state of the art methods for the same running time. To do so, we introduce a novel polynomial time algorithm for constructing an optimal contraction tree from a given order. Furthermore, we introduce a fast and high quality linear ordering solver, and demonstrate its applicability as a heuristic for providing orderings for contraction trees. Finally, we compare our solver with competing methods for constructing contraction trees in quantum circuit simulation on a collection of randomly generated Quantum Approximate Optimization Algorithm Max Cut circuits and show that our method achieves superior results on a majority of tested quantum circuits. Reproducibility: Our source code and data are available at https://github.com/cameton/HPEC2022_ContractionTrees.

quant-ph↗

arXiv2022

A Survey of Quantum Computing for Finance

Quantum computers are expected to surpass the computational capabilities of classical computers during this decade and have transformative impact on numerous industry sectors, particularly finance. In fact, finance is estimated to be the first industry sector to benefit from quantum computing, not only in the medium and long terms, but even in the short term. This survey paper presents a comprehensive summary of the state of the art of quantum computing for financial applications, with particular emphasis on stochastic modeling, optimization, and machine learning, describing how these solutions, adapted to work on a quantum computer, can potentially help to solve financial problems, such as derivative pricing, risk modeling, portfolio optimization, natural language processing, and fraud detection, more efficiently and accurately. We also discuss the feasibility of these algorithms on near-term quantum computers with various hardware implementations and demonstrate how they relate to a wide range of use cases in finance. We hope this article will not only serve as a reference for academic researchers and industry practitioners but also inspire new ideas for future research.

quant-ph↗

arXiv2022

Layer VQE: A Variational Approach for Combinatorial Optimization on Noisy Quantum Computers

Combinatorial optimization on near-term quantum devices is a promising path to demonstrating quantum advantage. However, the capabilities of these devices are constrained by high noise or error rates. In this paper, we propose an iterative Layer VQE (L-VQE) approach, inspired by the Variational Quantum Eigensolver (VQE). We present a large-scale numerical study, simulating circuits with up to 40 qubits and 352 parameters, that demonstrates the potential of the proposed approach. We evaluate quantum optimization heuristics on the problem of detecting multiple communities in networks, for which we introduce a novel qubit-frugal formulation. We numerically compare L-VQE with Quantum Approximate Optimization Algorithm (QAOA) and demonstrate that QAOA achieves lower approximation ratios while requiring significantly deeper circuits. We show that L-VQE is more robust to finite sampling errors and has a higher chance of finding the solution as compared with standard VQE approaches. Our simulation results show that L-VQE performs well under realistic hardware noise.

quant-ph↗

arXiv2022

Unitary Selective Coupled-Cluster Method

Simulating molecules using the Variational Quantum Eigensolver method is one of the promising applications for NISQ-era quantum computers. Designing an efficient ansatz to represent the electronic wave function is crucial in such simulations. Standard unitary coupled-cluster with singles and doubles (UCCSD) ansatz tends to have a large number of insignificant terms that do not lower the energy of the system. In this work, we present a unitary selective coupled-cluster method, a way to construct a unitary coupled-cluster ansatz iteratively using a selection procedure with excitations up to fourth order. This approach uses the electronic Hamiltonian matrix elements and the amplitudes for excitations already present in the ansatz to find the important excitations of higher order and to add them to the ansatz. The important feature of the method is that it systematically reduces the energy error with increasing ansatz size for a set of test molecules. The main advantage of the proposed method is that the effort to increase the ansatz does not require any additional measurements on a quantum computer.

physics.chem-ph↗

arXiv2022

Augmenting QAOA Ansatz with Multiparameter Problem-Independent Layer

The quantum approximate optimization algorithm (QAOA) promises to solve classically intractable computational problems in the area of combinatorial optimization. A growing amount of evidence suggests that the originally proposed form of the QAOA ansatz is not optimal, however. To address this problem, we propose an alternative ansatz, which we call QAOA+, that augments the traditional $p = 1$ QAOA ansatz with an additional multiparameter problem-independent layer. The QAOA+ ansatz allows obtaining higher approximation ratios than $p = 1$ QAOA while keeping the circuit depth below that of $p = 2$ QAOA, as benchmarked on the MaxCut problem for random regular graphs. We additionally show that the proposed QAOA+ ansatz, while using a larger number of trainable classical parameters than with the standard QAOA, in most cases outperforms alternative multiangle QAOA ansätze.

quant-ph↗

arXiv2022

Tensor Network Quantum Simulator With Step-Dependent Parallelization

In this work, we present a new large-scale quantum circuit simulator. It is based on the tensor network contraction technique to represent quantum circuits. We propose a novel parallelization algorithm based on \stepslice . In this paper, we push the requirement on the size of a quantum computer that will be needed to demonstrate the advantage of quantum computation with Quantum Approximate Optimization Algorithm (QAOA). We computed 210 qubit QAOA circuits with 1,785 gates on 1,024 nodes of the the Cray XC 40 supercomputer Theta. To the best of our knowledge, this constitutes the largest QAOA quantum circuit simulations reported to this date.

quant-ph↗

arXiv2022

Performance Evaluation and Acceleration of the QTensor Quantum Circuit Simulator on GPUs

This work studies the porting and optimization of the tensor network simulator QTensor on GPUs, with the ultimate goal of simulating quantum circuits efficiently at scale on large GPU supercomputers. We implement NumPy, PyTorch, and CuPy backends and benchmark the codes to find the optimal allocation of tensor simulations to either a CPU or a GPU. We also present a dynamic mixed backend to achieve optimal performance. To demonstrate the performance, we simulate QAOA circuits for computing the MaxCut energy expectation. Our method achieves $176\times$ speedup on a GPU over the NumPy baseline on a CPU for the benchmarked QAOA circuits to solve MaxCut problem on a 3-regular graph of size 30 with depth $p=4$.

quant-ph↗

arXiv2022

Localized Quantum Chemistry on Quantum Computers

Quantum chemistry calculations of large, strongly correlated systems are typically limited by the computation cost that scales exponentially with the size of the system. Quantum algorithms, designed specifically for quantum computers, can alleviate this, but the resources required are still too large for today's quantum devices. Here we present a quantum algorithm that combines a localization of multireference wave functions of chemical systems with quantum phase estimation (QPE) and variational unitary coupled cluster singles and doubles (UCCSD) to compute their ground state energy. Our algorithm, termed "local active space unitary coupled cluster" (LAS-UCC), scales linearly with system size for certain geometries, providing a polynomial reduction in the total number of gates compared with QPE, while providing accuracy above that of the variational quantum eigensolver using the UCCSD ansatz and also above that of the classical local active space self-consistent field. The accuracy of LAS-UCC is demonstrated by dissociating (H$_2$)$_2$ into two H$_2$ molecules and by breaking the two double bonds in trans-butadiene and resources estimates are provided for linear chains of up to 20 H$_2$ molecules.

quant-ph↗

arXiv2021

Quantum time dynamics of 1D-Heisenberg models employing the Yang-Baxter equation for circuit compression

Quantum time dynamics (QTD) is considered a promising problem for quantum supremacy on near-term quantum computers. However, QTD quantum circuits grow with increasing time simulations. This study focuses on simulating the time dynamics of 1-D integrable spin chains with nearest neighbor interactions. We show how the quantum Yang-Baxter equation can be exploited to compress and produce a shallow quantum circuit. With this compression scheme, the depth of the quantum circuit becomes independent of step size and only depends on the number of spins. We show that the compressed circuit scales quadratically with system size, which allows for the simulations of time dynamics of very large 1-D spin chains. We derive the compressed circuit representations for different special cases of the Heisenberg Hamiltonian. We compare and demonstrate the effectiveness of this approach by performing simulations on quantum computers.

quant-ph↗

arXiv2021

VQE Method: A Short Survey and Recent Developments

The variational quantum eigensolver (VQE) is a method that uses a hybrid quantum-classical computational approach to find eigenvalues and eigenvalues of a Hamiltonian. VQE has been proposed as an alternative to fully quantum algorithms such as quantum phase estimation because fully quantum algorithms require quantum hardware that will not be accessible in the near future. VQE has been successfully applied to solve the electronic Schrödinger equation for a variety of small molecules. However, the scalability of this method is limited by two factors: the complexity of the quantum circuits and the complexity of the classical optimization problem. Both of these factors are affected by choice of the variational ansatz used to represent the trial wave function. Hence, the construction of efficacious ansatz is an active area of research. Put another way, modern quantum computers are not capable of executing deep quantum circuits produced by using currently available ansatze for problems that map onto more than several qubits. In this review, we present recent developments in the field of designing effective ansatzes that fall into two categories -- chemistry inspired and hardware efficient -- that produce quantum circuits that are easier to run on modern hardware. We discuss the shortfalls of ansatzes originally formulated for VQE simulations, how they are addressed in more sophisticated methods, and the potential ways for further improvements.

quant-ph↗

arXiv2021

Impacts of Noise and Structure on Quantum Information Encoded in a Quantum Memory

As larger, higher-quality quantum devices are built and demonstrated in quantum information applications, such as quantum computation and quantum communication, the need for high-quality quantum memories to store quantum states becomes ever more pressing. Future quantum devices likely will use a variety of physical hardware, some being used primarily for processing of quantum information and others for storage. Here, we study the correlation of the structure of quantum information with physical noise models of various possible quantum memory implementations. Through numerical simulation of different noise models and approximate analytical formulas applied to a variety of interesting quantum states, we provide comparisons between quantum hardware with different structure, including both qubit- and qudit-based quantum memories. Our findings point to simple, experimentally relevant formulas for the relative lifetimes of quantum information in different quantum memories and have relevance to the design of hybrid quantum devices.

quant-ph↗

arXiv2021

Importance of Diagonal Gates in Tensor Network Simulations

In this work we present two techniques that tremendously increase the performance of tensor-network based quantum circuit simulations. The techniques are implemented in the QTensor package and benchmarked using Quantum Approximate Optimization Algorithm (QAOA) circuits. The techniques allowed us to increase the depth and size of QAOA circuits that can be simulated. In particular, we increased the QAOA depth from 2 to 5 and the size of a QAOA circuit from 180 to 244 qubits. Moreover, we increased the speed of simulations by up to 10 million times. Our work provides important insights into how various techniques can dramatically speed up the simulations of circuits.

quant-ph↗

arXiv2021

Transferability of optimal QAOA parameters between random graphs

The Quantum approximate optimization algorithm (QAOA) is one of the most promising candidates for achieving quantum advantage through quantum-enhanced combinatorial optimization. In a typical QAOA setup, a set of quantum circuit parameters is optimized to prepare a quantum state used to find the optimal solution of a combinatorial optimization problem. Several empirical observations about optimal parameter concentration effects for special QAOA MaxCut problem instances have been made in recent literature, however, a rigorous study of the subject is still lacking. We show that convergence of the optimal QAOA parameters around specific values and, consequently, successful transferability of parameters between different QAOA instances can be explained and predicted based on the local properties of the graphs, specifically the types of subgraphs (lightcones) from which the graphs are composed. We apply this approach to random regular and general random graphs. For example, we demonstrate how optimized parameters calculated for a 6-node random graph can be successfully used without modification as nearly optimal parameters for a 64-node random graph, with less than 1% reduction in approximation ratio as a result. This work presents a pathway to identifying classes of combinatorial optimization instances for which such variational quantum algorithms as QAOA can be substantially accelerated.

quant-ph↗