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We introduce a machine-learning (ML) framework for high-throughput benchmarking of diverse representations of chemical systems against datasets of materials and molecules. The guiding principle underlying the benchmarking approach is to…

Machine Learning · Computer Science 2021-12-07 Carl Poelking , Felix A. Faber , Bingqing Cheng

Density-functional theory is a formally exact description of a many-body quantum system in terms of its density; in practice, however, approximations to the universal density functional are required. In this work, a model based on deep…

Computational Physics · Physics 2016-08-02 Jeffrey M. McMahon

Tensor network quantum machine learning (QML) models are promising applications on near-term quantum hardware. While decoherence of qubits is expected to decrease the performance of QML models, it is unclear to what extent the diminished…

Quantum Physics · Physics 2023-01-30 Haoran Liao , Ian Convy , Zhibo Yang , K. Birgitta Whaley

It has been hypothesized that quantum computers may lend themselves well to applications in machine learning. In the present work, we analyze function classes defined via quantum kernels. Quantum computers offer the possibility to…

Quantum Physics · Physics 2021-11-10 Jonas M. Kübler , Simon Buchholz , Bernhard Schölkopf

Mainstream machine-learning techniques such as deep learning and probabilistic programming rely heavily on sampling from generally intractable probability distributions. There is increasing interest in the potential advantages of using…

Quantum Physics · Physics 2018-01-29 Marcello Benedetti , John Realpe-Gómez , Rupak Biswas , Alejandro Perdomo-Ortiz

The flow matching has rapidly become a dominant paradigm in classical generative modeling, offering an efficient way to interpolate between two complex distributions. We extend this idea to the quantum realm and introduce the Quantum Flow…

Quantum Physics · Physics 2026-02-03 Zidong Cui , Pan Zhang , Ying Tang

This paper presents a strategy for efficient quantum circuit design for density estimation. The strategy is based on a quantum-inspired algorithm for density estimation and a circuit optimisation routine based on memetic algorithms. The…

Quantum extreme learning machines (QELMs) are unconventional computing architectures that bear remarkable promise in both classical and quantum machine-learning tasks, such as the estimate of quantum state properties. However, the…

Hybrid quantum-classical models represent a crucial step toward leveraging near-term quantum devices for sequential data processing. We present Quantum Recurrent Neural Networks (QRNNs) and Quantum Convolutional Neural Networks (QCNNs) as…

Quantum Physics · Physics 2025-12-16 Stefan Balauca , Ada-Astrid Balauca , Adrian Iftene

Financial services is a prospect industry where unlocked near-term quantum utility could yield profitable potential, and, in particular, quantum machine learning algorithms could potentially benefit businesses by improving the quality of…

Quantum Machine Learning (QML) has surfaced as a pioneering framework addressing sequential control tasks and time-series modeling. It has demonstrated empirical quantum advantages notably within domains such as Reinforcement Learning (RL)…

Quantum Physics · Physics 2024-02-28 Samuel Yen-Chi Chen

We introduce the Knob-Meter-Rule (KMR) framework, a unified formalism for representing and reasoning about model efficiency techniques in deep learning. By abstracting diverse methods, including pruning, quantization, knowledge…

Machine Learning · Computer Science 2025-08-20 Naman Tyagi , Srishti Das , Kunal , Vatsal Gupta

Quantum machine learning (QML) can complement the growing trend of using learned models for a myriad of classification tasks, from image recognition to natural speech processing. A quantum advantage arises due to the intractability of…

Quantum Physics · Physics 2021-03-11 William M Watkins , Samuel Yen-Chi Chen , Shinjae Yoo

Machine learning techniques have led to broad adoption of a statistical model of computing. The statistical distributions natively available on quantum processors are a superset of those available classically. Harnessing this attribute has…

Leveraging the intrinsic probabilistic nature of quantum systems, generative quantum machine learning (QML) offers the potential to outperform classical learning models. Current generative QML algorithms mostly rely on general-purpose…

Quantum Physics · Physics 2025-05-06 Bence Bakó , Dániel T. R. Nagy , Péter Hága , Zsófia Kallus , Zoltán Zimborás

Quantum machine learning (QML) is a rapidly expanding field that merges the principles of quantum computing with the techniques of machine learning. One of the powerful mathematical frameworks in this domain is tensor networks. These…

Quantum Physics · Physics 2025-05-27 Alex Mossi , Bojan Žunkovic , Kyriakos Flouris

Universality of neural networks describes the ability to approximate arbitrary function, and is a key ingredient to keep the method effective. The established models for universal quantum neural networks(QNN), however, require the…

Quantum Physics · Physics 2021-10-22 Xiaokai Hou , Guanyu Zhou , Qingyu Li , Shan Jin , Xiaoting Wang

The rapid increase in the volume of data increased the size and complexity of the deep learning models. These models are now more resource-intensive and time-consuming for training than ever. This paper presents a quantum transfer learning…

Quantum Physics · Physics 2024-09-04 Sounak Bhowmik , Himanshu Thapliyal

Quantum machine learning seeks to exploit the underlying nature of a quantum computer to enhance machine learning techniques. A particular framework uses the quantum property of superposition to store sets of parameters, thereby creating an…

Quantum Physics · Physics 2020-01-30 Amira Abbas , Maria Schuld , Francesco Petruccione

Quantum neural networks have emerged as promising quantum machine learning models, leveraging the properties of quantum systems and classical optimization to solve complex problems in physics and beyond. However, previous studies have…

Quantum Physics · Physics 2025-06-17 Mingrui Jing , Erdong Huang , Xiao Shi , Shengyu Zhang , Xin Wang