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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…

Quantum Physics · Physics 2022-04-14 Danylo Lykov , Angela Chen , Huaxuan Chen , Kristopher Keipert , Zheng Zhang , Tom Gibbs , Yuri Alexeev

The advent of noisy-intermediate scale quantum computers has introduced the exciting possibility of achieving quantum speedups in machine learning tasks. These devices, however, are composed of a small number of qubits, and can faithfully…

Quantum Physics · Physics 2023-08-24 Rohit Dilip , Yu-Jie Liu , Adam Smith , Frank Pollmann

Simulating quantum circuits is a computationally intensive task that relies heavily on tensor products and matrix multiplications, which can be inefficient. Recent advancements, eliminate the need for tensor products and matrix…

Quantum computing holds promise for revolutionizing computational chemistry simulations, particularly in drug discovery. However, current quantum hardware is limited by noise and scale, necessitating bridging technologies. This study…

Quantum Physics · Physics 2025-04-16 Marek Kowalik , Ellen Michael , Peter Pogány , Phalgun Lolur

Machine learning has blossomed in recent decades and has become essential in many fields. It significantly solved some problems in particle physics -- particle reconstruction, event classification, etc. However, it is now time to break the…

High Energy Physics - Experiment · Physics 2024-03-13 Abdualazem Fadol , Qiyu Sha , Yaquan Fang , Zhan Li , Sitian Qian , Yuyang Xiao , Yu Zhang , Chen Zhou

Classical simulations of quantum circuits are vital for assessing potential quantum advantage and benchmarking devices, yet they require sophisticated methods to avoid the exponential growth of resources. Tensor network approaches, in…

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…

Quantum Physics · Physics 2022-10-31 William Berquist , Danylo Lykov , Minzhao Liu , Yuri Alexeev

With the rapid progress in quantum hardware and software, the need for verification of quantum systems becomes increasingly crucial. While model checking is a dominant and very successful technique for verifying classical systems, its…

Data Structures and Algorithms · Computer Science 2025-03-07 Xin Hong , Dingchao Gao , Sanjiang Li , Shenggang Ying , Mingsheng Ying

Quantum network simulators offer the opportunity to cost-efficiently investigate potential avenues to building networks that scale with the number of users, communication distance, and application demands by simulating alternative hardware…

Quantum Physics · Physics 2024-08-13 Xiaoliang Wu , Alexander Kolar , Joaquin Chung , Dong Jin , Rajkumar Kettimuthu , Martin Suchara

We demonstrate that large language model (LLM) agents can autonomously perform tensor network simulations of quantum many-body systems, achieving approximately 90% success rate across representative benchmark tasks. Tensor network methods…

Quantum Physics · Physics 2026-01-16 Weitang Li , Jiajun Ren , Lixue Cheng , Cunxi Gong

Quantum algorithms reformulate computational problems as quantum evolutions in a large Hilbert space. Most quantum algorithms assume that the time-evolution is perfectly unitary and that the full Hilbert space is available. However, in…

Quantum Physics · Physics 2024-09-26 Marcel Niedermeier , Jose L. Lado , Christian Flindt

Machine learning and quantum computing are two technologies that are causing a paradigm shift in the performance and behavior of certain algorithms, achieving previously unattainable results. Machine learning (kernel classification) has…

Quantum Physics · Physics 2020-04-28 Siddharth Sharma

Quantum machine learning (QML) is a fast-growing discipline within quantum computing. One popular QML algorithm, quantum kernel estimation, uses quantum circuits to estimate a similarity measure (kernel) between two classical feature…

Quantum Physics · Physics 2023-07-12 Travis L. Scholten , Derrick Perry , Joseph Washington , Jennifer R. Glick , Thomas Ward

We investigate quantum algorithms derived from tensor networks to simulate the static and dynamic properties of quantum many-body systems. Using a sequentially prepared quantum circuit representation of a matrix product state (MPS) that we…

Quantum Physics · Physics 2024-12-04 Michael L. Wall , Aidan Reilly , John S. Van Dyke , Collin Broholm , Paraj Titum

Significant challenges remain with the development of macroscopic quantum computing, hardware problems of noise, decoherence, and scaling, software problems of error correction, and, most important, algorithm construction. Finding truly…

Quantum Physics · Physics 2022-12-05 James E. Steck , Nathan L. Thompson , Elizabeth C. Behrman

Quantum computing has become increasingly practical in solving real-world problems due to advances in hardware and algorithms. In this paper, we aim to design and estimate quantum machine learning and hybrid quantum-classical models in a…

Quantum Physics · Physics 2025-07-14 Leyang Wang , Yilun Gong , Zongrui Pei

The support vector clustering algorithm is a well-known clustering algorithm based on support vector machines using Gaussian or polynomial kernels. The classical support vector clustering algorithm works well in general, but its performance…

Machine Learning · Computer Science 2020-05-27 Arit Kumar Bishwas , Ashish Mani , Vasile Palade

We propose Scalable Quantum Molecular Generation (SQMG), a variational quantum-circuit for sampling molecular graphs using chemical priors on atoms and bonds. SQMG assigns a fixed 3-qubit register to each heavy atom and reuses a single…

This work presents a fully quantum approach to support vector machine (SVM) learning by integrating gate-based quantum kernel methods with quantum annealing-based optimization. We explore the construction of quantum kernels using various…

Quantum Physics · Physics 2025-09-08 Mario Bifulco , Luca Roversi

Machine learning and quantum computing are two technologies each with the potential for altering how computation is performed to address previously untenable problems. Kernel methods for machine learning are ubiquitous for pattern…