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Quantum machine learning for spin and molecular systems faces critical challenges of scarce labeled data and computationally expensive simulations. To address these limitations, we introduce Hamiltonian-Masked Autoencoding (HMAE), a novel…

Quantum Physics · Physics 2025-10-29 Ibne Farabi Shihab , Sanjeda Akter , Anuj Sharma

Hierarchical Bayesian models are increasingly used in large, inhomogeneous complex network dynamical systems by modeling parameters as draws from a hyperparameter-governed distribution. However, theoretical guarantees for these estimates as…

Statistics Theory · Mathematics 2026-01-23 Yi Yu , Yubo Hou , Yinchong Wang , Nan Zhang , Jianfeng Feng , Wenlian Lu

Inferring the dynamical generator of a many-body quantum system from measurement data is essential for the verification, calibration, and control of quantum processors. When the system is open, this task becomes considerably harder than in…

This paper presents a novel holistic deep learning framework that simultaneously addresses the challenges of vulnerability to input perturbations, overparametrization, and performance instability from different train-validation splits. The…

The neural network-based approach to solving partial differential equations has attracted considerable attention due to its simplicity and flexibility in representing the solution of the partial differential equation. In training a neural…

Machine Learning · Computer Science 2022-01-10 Jihun Han , Yoonsang Lee

We present an empirical strategy to determine the Hamiltonian dynamics of a two-qubit system using only initialization and measurement in a single fixed basis. Signal parameters are estimated from measurement data using Bayesian methods…

Quantum Physics · Physics 2009-10-01 S. G. Schirmer , D. K. L. Oi

Recently, there has been an increasing interest in modelling and computation of physical systems with neural networks. Hamiltonian systems are an elegant and compact formalism in classical mechanics, where the dynamics is fully determined…

Numerical Analysis · Mathematics 2022-06-28 Elena Celledoni , Andrea Leone , Davide Murari , Brynjulf Owren

We introduce a robust, error-tolerant adaptive training algorithm for generalized learning paradigms in high-dimensional superposed quantum networks, or \emph{adaptive quantum networks}. The formalized procedure applies standard…

Neurons and Cognition · Quantitative Biology 2015-05-13 Christopher Altman , Romàn R. Zapatrin

Forgetting a subset in machine unlearning is rarely an isolated task. Often, retained samples that are closely related to the forget set can be unintentionally affected, particularly when they share correlated features from pretraining or…

Machine Learning · Computer Science 2026-03-30 Jingpu Cheng , Ping Liu , Qianxiao Li , Chi Zhang

A well-studied scenario in quantum parameter estimation theory arises when the parameter to be estimated is imprinted on the initial state by a Hamiltonian of the form $\theta G$. For such "phase shift Hamiltonians" it has been shown that…

Quantum Physics · Physics 2017-07-05 Julien Mathieu Elias Fraisse , Daniel Braun

Characterizing the Hamiltonians of continuous-variable (CV) quantum systems is a fundamental challenge laden with difficulties arising from infinite-dimensional Hilbert spaces and unbounded operators. Existing protocols for achieving the…

Quantum Physics · Physics 2025-10-10 Xi Huang , Lixing Zhang , Di Luo

We present hierarchical learning, a novel variational architecture for efficient training of large-scale variational quantum circuits. We test and benchmark our technique for distribution loading with quantum circuit born machines (QCBMs).…

Quantum Physics · Physics 2023-11-23 Hrant Gharibyan , Vincent Su , Hayk Tepanyan

Quantum convolutional neural networks (QCNNs) have been introduced as classifiers for gapped quantum phases of matter. Here, we propose a model-independent protocol for training QCNNs to discover order parameters that are unchanged under…

Quantum Physics · Physics 2023-06-05 Yu-Jie Liu , Adam Smith , Michael Knap , Frank Pollmann

The characterization of Hamiltonians and other components of open quantum dynamical systems plays a crucial role in quantum computing and other applications. Scientific machine learning techniques have been applied to this problem in a…

Quantum Physics · Physics 2026-04-07 Peter Sentz , Stanley Nicholson , Yujin Cho , Sohail Reddy , Brendan Keith , Stefanie Günther

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

We introduce a robust framework for learning various generalized Hamiltonian dynamics from noisy, sparse phase-space data and in an unsupervised manner based on variational Bayesian inference. Although conservative, dissipative, and…

Machine Learning · Computer Science 2025-09-10 Luke McLennan , Yi Wang , Ryan Farell , Minh Nguyen , Chandrajit Bajaj

In this paper we design and use two Deep Learning models to generate the ground and excited wavefunctions of different Hamiltonians suitable for the study the vibrations of molecular systems. The generated neural networks are trained with…

Chemical Physics · Physics 2021-11-24 Laia Domingo , Florentino Borondo

We consider the problems of testing and learning an unknown $n$-qubit Hamiltonian $H$ from queries to its evolution operator $e^{-iHt}$ under the normalized Frobenius norm. We prove: 1. Local Hamiltonians: We give a tolerant testing…

Quantum Physics · Physics 2025-06-09 Srinivasan Arunachalam , Arkopal Dutt , Francisco Escudero Gutiérrez

Quantum machine learning aims to release the prowess of quantum computing to improve machine learning methods. By combining quantum computing methods with classical neural network techniques we aim to foster an increase of performance in…

High Energy Physics - Phenomenology · Physics 2021-03-17 Andrew Blance , Michael Spannowsky

We formalize and study the Hamiltonian certification problem. Given access to $e^{-\mathrm{i} Ht}$ for an unknown Hamiltonian $H$, the goal of the problem is to determine whether $H$ is $\varepsilon_1$-close to or $\varepsilon_2$-far from a…

Quantum Physics · Physics 2026-05-07 Minbo Gao , Zhengfeng Ji , Qisheng Wang , Wenjun Yu , Qi Zhao