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Mesoscopic pattern extraction (MPE) is the problem of finding a partition of the nodes of a complex network that maximizes some objective function. Many well-known network inference problems fall in this category, including, for instance,…

Physics and Society · Physics 2018-10-03 Jean-Gabriel Young , Guillaume St-Onge , Patrick Desrosiers , Louis J. Dubé

A new ensemble interpretation of quantum mechanics is proposed according to which the ensemble associated to a quantum state really exists: it is the ensemble of all the systems in the same quantum state in the universe. Individual systems…

Quantum Physics · Physics 2015-05-27 Lee Smolin

Machine learning (ML) surrogate models are increasingly used in engineering analysis and design to replace computationally expensive simulation models, significantly reducing computational cost and accelerating decision-making processes.…

Machine Learning · Statistics 2025-07-22 Xiaoping Du

On noisy intermediate-scale quantum (NISQ) devices, expectation values of many observables are obtained through sampling-based approximations to trace-like quantities. A central limitation of this approach is destructive cancellation under…

Quantum Physics · Physics 2026-05-06 Myeongsu Kim , Manas Sajjan , Sabre Kais

Mechanistic understanding and rational design of complex chemical systems depend on fast and accurate predictions of electronic structures beyond individual building blocks. However, if the system exceeds hundreds of atoms, first-principles…

Chemical Physics · Physics 2026-04-13 Siqi Chen , Zhiqiang Wang , Yili Shen , Xianqi Deng , Xi Cheng , Cheng-Wei Ju , Jun Yi , Guo Ling , Dieaa Alhmoud , Hui Guan , Zhou Lin

Quantum computers progress toward outperforming classical supercomputers, but quantum errors remain their primary obstacle. The key to overcoming errors on near-term devices has emerged through the field of quantum error mitigation,…

Quantum Physics · Physics 2025-05-14 Haoran Liao , Derek S. Wang , Iskandar Sitdikov , Ciro Salcedo , Alireza Seif , Zlatko K. Minev

The potential energy surface (PES) of molecules with respect to their nuclear positions is a primary tool in understanding chemical reactions from first principles. However, obtaining this information is complicated by the fact that…

The minimum Kullback entropy principle (mKE) is a useful tool to estimate quantum states and operations from incomplete data and prior information. In general, the solution of a mKE problem is analytically challenging and an approximate…

Quantum Physics · Physics 2015-06-18 Carlo Sparaciari , Stefano Olivares , Francesco Ticozzi , Matteo G. A. Paris

Machine learning algorithms often take inspiration from established results and knowledge from statistical physics. A prototypical example is the Boltzmann machine algorithm for supervised learning, which utilizes knowledge of classical…

Statistical Mechanics · Physics 2018-12-04 Tatjana Puskarov , Axel Cortes Cubero

Quantum metrology holds the promise of an early practical application of quantum technologies, in which measurements of physical quantities can be made with much greater precision than what is achievable with classical technologies. In this…

Quantum Physics · Physics 2021-01-27 Jasminder S. Sidhu , Pieter Kok

Quantum phase estimation (QPE) is the key subroutine of several quantum computing algorithms as well as a central ingredient in quantum computational chemistry and quantum simulation. While QPE strategies have focused on the estimation of a…

Quantum Physics · Physics 2021-07-26 Valentin Gebhart , Augusto Smerzi , Luca Pezzè

Generalization bounds are a critical tool to assess the training data requirements of Quantum Machine Learning (QML). Recent work has established guarantees for in-distribution generalization of quantum neural networks (QNNs), where…

Generalization is a central concept in machine learning theory, yet for quantum models, it is predominantly analyzed through uniform bounds that depend on a model's overall capacity rather than the specific function learned. These…

Quantum machine learning (QML) is rapidly transitioning from theoretical promise to practical relevance across data-intensive scientific domains. In this Review, we provide a structured overview of recent advances that bridge foundational…

Quantum Physics · Physics 2026-02-25 Vinit Singh , Amandeep Singh Bhatia , Mandeep Kaur Saggi , Manas Sajjan , Sabre Kais

We propose a general strategy to develop quantum many-body approximations of primitives in linear algebra algorithms. As a practical example, we introduce a coupled-cluster inspired framework to produce approximate Hamiltonian moments, and…

Chemical Physics · Physics 2025-12-30 Yuhang Ai , Huanchen Zhai , Johannes Tölle , Garnet Kin-Lic Chan

We propose a Quantum Machine Learning (QML) framework that leverages quantum parallelism to process entire training datasets in a single quantum operation, addressing the computational bottleneck of sequential data processing in both…

An efficient state estimation model, neural network estimation (NNE), empowered by machine learning techniques, is presented for full quantum state tomography (FQST). A parameterized function based on neural network is applied to map the…

Quantum Physics · Physics 2018-11-20 Qian Xu , Shuqi Xu

A simple yet efficient method of linear regression estimation (LRE) is presented for quantum state tomography. In this method, quantum state reconstruction is converted into a parameter estimation problem of a linear regression model and…

Quantum Physics · Physics 2013-12-18 Bo Qi , Zhibo Hou , Li Li , Daoyi Dong , Guoyong Xiang , Guangcan Guo

Recent experimental breakthroughs have signalled the imminent arrival of the early fault-tolerant era. However, for a considerable period in the foreseeable future, relying solely on quantum error correction for full error suppression will…

Quantum Physics · Physics 2025-02-18 Kecheng Liu , Zhenyu Cai

We derive an exact equation of motion for the reduced density matrices of individual subsystems of quantum many-body systems of any lattice dimension and arbitrary system size. Our projection operator based theory yields a highly efficient…

Quantum Physics · Physics 2014-06-13 Peter Degenfeld-Schonburg , Michael J. Hartmann
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