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Value function based reinforcement learning (RL) algorithms, for example, $Q$-learning, learn optimal policies from datasets of actions, rewards, and state transitions. However, when the underlying state transition dynamics are stochastic…

Machine Learning · Computer Science 2022-03-29 Udari Madhushani , Biswadip Dey , Naomi Ehrich Leonard , Amit Chakraborty

We present a general framework to tackle the problem of finding time-independent dynamics generating target unitary evolutions. We show that this problem is equivalently stated as a set of conditions over the spectrum of the…

Quantum Physics · Physics 2020-06-08 Luca Innocenti , Leonardo Banchi , Alessandro Ferraro , Sougato Bose , Mauro Paternostro

In this work we extend the notion of universal quantum Hamiltonians to the setting of translationally-invariant systems. We present a construction that allows a two-dimensional spin lattice with nearest-neighbour interactions, open…

Quantum Physics · Physics 2020-01-23 Stephen Piddock , Johannes Bausch

Machine-learning electronic Hamiltonians achieve orders-of-magnitude speedups over density-functional theory, yet current models omit long-range Coulomb interactions that govern physics in polar crystals and heterostructures. We derive…

Computational Physics · Physics 2026-03-23 Yang Zhong , Xiwen Li , Xingao Gong , Hongjun Xiang

Deep learning methods for electronic-structure Hamiltonian prediction has offered significant computational efficiency advantages over traditional DFT methods, yet the diversity of atomic types, structural patterns, and the high-dimensional…

Machine Learning · Computer Science 2026-03-03 Shi Yin , Zujian Dai , Xinyang Pan , Lixin He

Recent works have shown that generic local Hamiltonians can be efficiently inferred from local measurements performed on their eigenstates or thermal states. Realistic quantum systems are often affected by dissipation and decoherence due to…

Quantum Physics · Physics 2020-03-25 Eyal Bairey , Chu Guo , Dario Poletti , Netanel H. Lindner , Itai Arad

Quantum process characterization is a fundamental task in quantum information processing, yet conventional methods, such as quantum process tomography, require prohibitive resources and lack scalability. Here, we introduce an efficient…

Quantum Physics · Physics 2025-04-11 Yusen Wu , Yukun Zhang , Chuan Wang , Xiao Yuan

Molecular quantum magnets adsorbed on surfaces exhibit rich spin and orbital excitations that can be probed by scanning tunneling microscopy with inelastic electron tunneling spectroscopy (STM-IETS). However, the quantitative extraction of…

Mesoscale and Nanoscale Physics · Physics 2026-01-28 Greta Lupi , Adolfo O. Fumega , Mohammad Amini , Robert Drost , Peter Liljeroth , Jose L. Lado

Hamiltonian mechanics is an effective tool to represent many physical processes with concise yet well-generalized mathematical expressions. A well-modeled Hamiltonian makes it easy for researchers to analyze and forecast many related…

Machine Learning · Computer Science 2021-02-24 Seungjun Lee , Haesang Yang , Woojae Seong

Schr\"odinger's equation serves as a fundamental component in characterizing quantum systems, wherein both quantum state tomography and Hamiltonian learning are instrumental in comprehending and interpreting quantum systems. While numerous…

Quantum Physics · Physics 2024-01-25 Zheng An , Jiahui Wu , Muchun Yang , D. L. Zhou , Bei Zeng

Hybrid machine learning based on Hamiltonian formulations has recently been successfully demonstrated for simple mechanical systems, both energy conserving and not energy conserving. We introduce a pseudo-Hamiltonian formulation that is a…

Machine Learning · Computer Science 2023-02-15 Sølve Eidnes , Alexander J. Stasik , Camilla Sterud , Eivind Bøhn , Signe Riemer-Sørensen

Trotterization is a standard approach for simulating quantum time evolution on quantum computers, where the Hamiltonian is split into local terms and each term is applied in sequence. The order of these terms affects the fidelity of the…

Quantum Physics · Physics 2026-05-01 Shamminuj Aktar , Reuben Tate , Stephan Eidenbenz

The (tolerant) Hamiltonian locality testing problem, introduced in [Bluhm, Caro,Oufkir `24], is to determine whether a Hamiltonian $H$ is $\varepsilon_1$-close to being $k$-local (i.e. can be written as the sum of weight-$k$ Pauli…

Quantum Physics · Physics 2025-05-13 John Kallaugher , Daniel Liang

Efficiently characterising quantum systems, verifying operations of quantum devices and validating underpinning physical models, are central challenges for the development of quantum technologies and for our continued understanding of…

Understanding and characterising quantum many-body dynamics remains a significant challenge due to both the exponential complexity required to represent quantum many-body Hamiltonians, and the need to accurately track states in time under…

Quantum Physics · Physics 2024-08-19 Timothy Heightman , Edward Jiang , Antonio Acín

We study a class of time-dependent (TD) non-Hermitian Hamiltonians $H(t)$ that can be transformed into a time-independent pseudo-Hermitian Hamiltonian $\mathcal{H}_{0}^{PH}$ using a suitable TD unitary transformation $F(t)$. The latter can…

Quantum Physics · Physics 2025-10-06 F. Kecita , B. Khantoul , A. Bounames

Digital quantum simulation of many-body dynamics relies on Trotterization to decompose the target time evolution into elementary quantum gates operating at a fixed equidistant time discretization. Recent advances have outlined protocols…

Quantum Physics · Physics 2024-06-11 Hongzheng Zhao , Ao Chen , Shu-Wei Liu , Marin Bukov , Markus Heyl , Roderich Moessner

Hamiltonian learning (HL), enabling precise estimation of system parameters and underlying dynamics, plays a critical role in characterizing quantum systems. However, conventional HL methods face challenges in noise robustness and resource…

Quantum Physics · Physics 2025-11-07 Jie Liu , Xin Wang

Estimating extensive combinations of local parameters in distributed quantum systems is a central problem in quantum sensing, with applications ranging from magnetometry to timekeeping. While optimal strategies are known for sensing…

Concise, accurate descriptions of physical systems through their conserved quantities abound in the natural sciences. In data science, however, current research often focuses on regression problems, without routinely incorporating…

Computational Physics · Physics 2020-02-05 Tom Bertalan , Felix Dietrich , Igor Mezić , Ioannis G. Kevrekidis
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