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A novel parallel hybrid quantum-classical algorithm for the solution of the quantum-chemical ground-state energy problem on gate-based quantum computers is presented. This approach is based on the reduced density-matrix functional theory…

This paper proposes a general decentralized framework for quantum kernel learning (QKL). It has robustness against quantum noise and can also be designed to defend adversarial information attacks forming a robust approach named RDQKL. We…

Quantum Physics · Physics 2025-04-21 Wenxuan Ma , Kuan-Cheng Chen , Shang Yu , Mengxiang Liu , Ruilong Deng

Quantum chemistry and optimization are two of the most prominent applications of quantum computers. Variational quantum algorithms have been proposed for solving problems in these domains. However, the design of the quantum circuit ansatz…

This paper narrows the gap between previous literature on quantum linear algebra and practical data analysis on a quantum computer, formalizing quantum procedures that speed-up the solution of eigenproblems for data representations in…

Quantum Physics · Physics 2022-08-09 Armando Bellante , Alessandro Luongo , Stefano Zanero

Ultrafast lasers have become one of the most powerful tools in coherent nonlinear optical spectroscopy. Short pulses enable direct observation of fast molecular dynamics, whereas broad spectral bandwidth offers ways of controlling nonlinear…

Chemical Physics · Physics 2015-05-13 X. G. Xu , S. O. Konorov , J. W. Hepburn , V. Milner

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

We present a novel approach to the regression of quantum mechanical energies based on a scattering transform of an intermediate electron density representation. A scattering transform is a deep convolution network computed with a cascade of…

Machine Learning · Computer Science 2016-05-23 Matthew Hirn , Nicolas Poilvert , Stéphane Mallat

Kohn-Sham Density Functional Theory (KS-DFT) provides the exact ground state energy and electron density of a molecule, contingent on the as-yet-unknown universal exchange-correlation (XC) functional. Recent research has demonstrated that…

We introduce a data-driven framework for approximating the convex set of $N$-representable two-electron reduced density matrices (2-RDMs). Traditional approaches characterize this set through linear matrix inequalities that define its…

Chemical Physics · Physics 2026-03-09 Luis H. Delgado-Granados , David A. Mazziotti

Quantum Machine Learning (QML) presents as a revolutionary approach to weather forecasting by using quantum computing to improve predictive modeling capabilities. In this study, we apply QML models, including Quantum Gated Recurrent Units…

Quantum Physics · Physics 2025-09-15 Saiyam Sakhuja , Shivanshu Siyanwal , Abhishek Tiwari , Britant , Savita Kashyap

We present a comprehensive reappraisal of the in-medium properties of the rho meson using the inverse QCD sum rules (QCDSR) formalism, offering a novel, model-independent approach to studying hadronic modifications in nuclear matter. Unlike…

High Energy Physics - Phenomenology · Physics 2025-05-21 Halil Mutuk

In this paper, we investigate a trade-off between the number of radar observations (or measurements) and their resolution in the context of radar range estimation. To this end, we introduce a novel estimation scheme that can deal with…

Signal Processing · Electrical Eng. & Systems 2018-11-29 Thomas Feuillen , Chunlei Xu , Jérôme Louveaux , Luc Vandendorpe , Laurent Jacques

Quotient regularization models (QRMs) are a class of powerful regularization techniques that have gained considerable attention in recent years, due to their ability to handle complex and highly nonlinear data sets. However, the nonconvex…

Numerical Analysis · Mathematics 2023-08-09 Chao Wang , Jean-Francois Aujol , Guy Gilboa , Yifei Lou

Reducing the dimension of nonlinear data is crucial in data processing and visualization. The locally linear embedding algorithm (LLE) is specifically a representative nonlinear dimensionality reduction method with well maintaining the…

Quantum Physics · Physics 2020-06-30 Xi He , Li Sun , Chufan Lyu , Xiaoting Wang

Shuffled linear regression (SLR) seeks to estimate latent features through a linear transformation, complicated by unknown permutations in the measurement dimensions. This problem extends traditional least-squares (LS) and Least Absolute…

Statistics Theory · Mathematics 2025-04-17 Hang Liu , Anna Scaglione

The observation of quantum dot resonance fluorescence enabled a new solid-state approach to generating single photons with a bandwidth almost as narrow as the natural linewidth of a quantum dot transition. Here, we operate in the Heitler…

Quantum Physics · Physics 2012-07-20 Clemens Matthiesen , Anthony Nickolas Vamivakas , Mete Atature

With the capability to find the best fit to arbitrarily complicated data patterns, machine-learning (ML) enhanced quantum state tomography (QST) has demonstrated its advantages in extracting complete information about the quantum states.…

Quantum Physics · Physics 2022-03-31 Hsien-Yi Hsieh , Jingyu Ning , Yi-Ru Chen , Hsun-Chung Wu , Hua Li Chen , Chien-Ming Wu , Ray-Kuang Lee

This paper extends the Radon transform, a classical image processing tool for fast tomography and denoising, to the quantum computing platform. A new kind of periodic discrete Radon transform (PDRT), called quantum Radon transform (QRT), is…

Quantum Physics · Physics 2021-07-13 Guangsheng Ma , Hongbo Li , Jiman Zhao

We present a real-space method for computing the random phase approximation (RPA) correlation energy within Kohn-Sham density functional theory, leveraging the low-rank nature of the frequency-dependent density response operator. In…

Computational Physics · Physics 2025-04-03 Boqin Zhang , Shikhar Shah , John E. Pask , Edmond Chow , Phanish Suryanarayana

The industry of quantum technologies is rapidly expanding, offering promising opportunities for various scientific domains. Among these emerging technologies, Quantum Machine Learning (QML) has attracted considerable attention due to its…

Quantum Physics · Physics 2023-11-15 Artur Miroszewski , Jakub Nalepa , Bertrand Le Saux , Jakub Mielczarek