The performance of quantum simulations heavily depends on the efficiency of noise mitigation techniques and error correction algorithms. Reinforcement has emerged as a powerful strategy to enhance the efficiency of learning and optimization algorithms. In this study, we demonstrate that a reinforced quantum dynamics can exhibit significant robustness against interactions with a noisy environment. We study a quantum annealing process where, through reinforcement, the system is encouraged to maintain its current state or follow a noise-free evolution. A learning algorithm is employed to derive a concise approximation of this reinforced dynamics, reducing the total evolution time and, consequently, the system's exposure to noisy interactions. This also avoids the complexities associated with implementing quantum feedback in such reinforcement algorithms. The efficacy of our method is demonstrated through numerical simulations of reinforced quantum annealing with one- and two-qubit systems under Pauli noise.

Simulating the dynamics of open quantum systems with spatial structure and external control is an important challenge in quantum information science. Classical numerical solvers for such systems require integrating coupled master and field equations, which is computationally demanding for simulation and optimization tasks and often precluding real-time use in network-scale simulations or feedback control. We introduce a regional attention-based neural architecture that learns the spatiotemporal dynamics of structured open quantum systems. The model incorporates translational invariance of physical laws as an inductive bias to achieve scalable complexity, and supports conditioning on time-dependent global control parameters. We demonstrate learning on two representative systems: a driven dissipative single qubit and an electromagnetically induced transparency (EIT) quantum memory. The model achieves high predictive fidelity under both in-distribution and out-of-distribution control protocols, and provides substantial acceleration up to three orders of magnitude over numerical solvers. These results demonstrate that the architecture establishes a general surrogate modeling framework for spatially structured open quantum dynamics, with immediate relevance to large-scale quantum network simulation, quantum repeater and protocol design, real-time experimental optimization, and scalable device modeling across diverse light-matter platforms.

Describing the dynamics of strong-laser driven open quantum systems is a very challenging task that requires the solution of highly involved equations of motion. While machine learning techniques are being applied with some success to simulate the time evolution of individual quantum states, their use to approximate time-dependent operators (that can evolve various states) remains largely unexplored. In this work, we develop driven neural quantum propagators (NQP), a universal neural network framework that solves driven-dissipative quantum dynamics by approximating propagators rather than wavefunctions or density matrices. NQP can handle arbitrary initial quantum states, adapt to various external fields, and simulate long-time dynamics, even when trained on far shorter time windows. Furthermore, by appropriately configuring the external fields, our trained NQP can be transferred to systems governed by different Hamiltonians. We demonstrate the effectiveness of our approach by studying the spin-boson and the three-state transition Gamma models.

Quantum dynamics compilation is an important task for improving quantum simulation efficiency: It aims to synthesize multi-qubit target dynamics into a circuit consisting of as few elementary gates as possible. Compared to deterministic methods such as Trotterization, variational quantum compilation (VQC) methods employ variational optimization to reduce gate costs while maintaining high accuracy. In this work, we explore the potential of a VQC scheme by making use of out-of-distribution generalization results in quantum machine learning (QML): By learning the action of a given many-body dynamics on a small data set of product states, we can obtain a unitary circuit that generalizes to highly entangled states such as the Haar random states. The efficiency in training allows us to use tensor network methods to compress such time-evolved product states by exploiting their low entanglement features. Our approach exceeds state-of-the-art compilation results in both system size and accuracy in one dimension ($1$D). For the first time, we extend VQC to systems on two-dimensional (2D) strips with a quasi-1D treatment, demonstrating a significant resource advantage over standard Trotterization methods, highlighting the method's promise for advancing quantum simulation tasks on near-term quantum processors.

Next Generation Reservoir Computing (NG-RC) is a modern class of model-free machine learning that enables an accurate forecasting of time series data generated by dynamical systems. We demonstrate that NG-RC can accurately predict full many-body quantum dynamics in both integrable and chaotic systems. This is in contrast to the conventional application of reservoir computing that concentrates on the prediction of the dynamics of observables. In addition, we apply a technique which we refer to as skipping ahead to predict far future states accurately without the need to extract information about the intermediate states. However, adopting a classical NG-RC for many-body quantum dynamics prediction is computationally prohibitive due to the large Hilbert space of sample input data. In this work, we propose an end-to-end quantum algorithm for many-body quantum dynamics forecasting with a quantum computational speedup via the block-encoding technique. This proposal presents an efficient model-free quantum scheme to forecast quantum dynamics coherently, bypassing inductive biases incurred in a model-based approach.

Entanglement serves as the resource to empower quantum computing. Recent progress has highlighted its positive impact on learning quantum dynamics, wherein the integration of entanglement into quantum operations or measurements of quantum machine learning (QML) models leads to substantial reductions in training data size, surpassing a specified prediction error threshold. However, an analytical understanding of how the entanglement degree in data affects model performance remains elusive. In this study, we address this knowledge gap by establishing a quantum no-free-lunch (NFL) theorem for learning quantum dynamics using entangled data. Contrary to previous findings, we prove that the impact of entangled data on prediction error exhibits a dual effect, depending on the number of permitted measurements. With a sufficient number of measurements, increasing the entanglement of training data consistently reduces the prediction error or decreases the required size of the training data to achieve the same prediction error. Conversely, when few measurements are allowed, employing highly entangled data could lead to an increased prediction error. The achieved results provide critical guidance for designing advanced QML protocols, especially for those tailored for execution on early-stage quantum computers with limited access to quantum resources.

A central problem of quantum physics, be it fundamental quantum physics or applications for quantum technology, is the ground state problem. It can be defined as finding a state vector |Ψ that minimises the expected value of the Hamiltonian Ĥ that represents the energetic interactions between the different parts that make up a quantum physical system. It is well-known that the difficulty of solving the ground state problem for a physical system arises from the exponential growth of the Hilbert space with respect to the number of the system components and their dimension. Therefore, techniques such as exact diagonalisation of Ĥ quickly render insufficient to find the ground state, and other approximate methods have to be used. Interestingly, other central problems of quantum physics such as finding the evolution of a quantum system can be cast into the ground state problem, as demonstrated by the Feynman-Kitaev formalism [24]. An immediate implication of using this formalism is that the computational tools historically developed for solving the ground state problem can be used to find the dynamics of a physical system. Broadly speaking, the Feynman-Kitaev formalism appends a clock as an auxilliary subsystem of the main physical system, i.e. the Hilbert space H of the whole system is H = P C, where P is the Hilbert space of the main physical system and C is the Hilbert space of the clock.

Experimental sciences have come to depend heavily on our ability to organize and interpret high-dimensional datasets. Natural laws, conservation principles, and inter-dependencies among observed variables yield geometric structure, with fewer degrees of freedom, on the dataset. We introduce the frameworks of semiclassical and microlocal analysis to data analysis and develop a novel, yet natural uncertainty principle for extracting fine-scale features of this geometric structure in data, crucially dependent on data-driven approximations to quantum mechanical processes underlying geometric optics. This leads to the first tractable algorithm for approximation of wave dynamics and geodesics on data manifolds with rigorous probabilistic convergence rates under the manifold hypothesis. We demonstrate our algorithm on real-world datasets, including an analysis of population mobility information during the COVID-19 pandemic to achieve four-fold improvement in dimensionality reduction over existing state-of-the-art and reveal anomalous behavior exhibited by less than 1.2% of the entire dataset. Our work initiates the study of data-driven quantum dynamics for analyzing datasets, and we outline several future directions for research.

Recently, efforts have been made in the community to design new Graph Neural Networks (GNN), as limitations of Message Passing Neural Networks became more apparent. This led to the appearance of Graph Transformers using global graph features such as Laplacian Eigenmaps. In our paper, we introduce a GNN architecture where the aggregation weights are computed using the long-range correlations of a quantum system. These correlations are generated by translating the graph topology into the interactions of a set of qubits in a quantum computer. This work was inspired by the recent development of quantum processing units which enables the computation of a new family of global graph features that would be otherwise out of reach for classical hardware. We give some theoretical insights about the potential benefits of this approach, and benchmark our algorithm on standard datasets. Although not being adapted to all datasets, our model performs similarly to standard GNN architectures, and paves a promising future for quantum enhanced GNNs. Graph machine learning is an expanding field of research with applications in chemistry (Gilmer et al., 2017), biology (Zitnik et al., 2018), drug design (Konaklieva, 2014), social networks (Scott, 2011), computer vision (Harchaoui & Bach, 2007), science (Sanchez-Gonzalez et al., 2020). In the past few years, much effort has been put into the design of Graph Neural Networks (GNN) (Hamilton). The goal is to learn a vector representation of the nodes while incorporating information about the graph. The learned information is then processed according to the original problem.

Deep learning and neural networks have recently become the powerhouse in machine learning (ML) and they have successfully been used to tackle complex problems In general, the study of open quantum systems are in classical [1-3] and quantum mechanics [4-7] (see Refs. important for quantum computing as well as many [8-12] for reviews). Machine-assisted scientific discovery other areas of physics from many-body phenomenon [27, is still in its infancy but progress has been made, mostly 28], light-matter interaction [29-31] to non-equilibrium by building the correct inductive bias-or structure into physics [32, 33]. the model or loss function. For example physical conservation laws can be learned [1, 2]. Other work has made progress, in a purely data-driven approach learning relationships between quantum experiments and entanglement Here, we demonstrate that latent ODEs can be trained using generative models [13]. Recently, neural to generate and extrapolate measurement data from dynamical ordinary differential equations (ODEs) were introduced quantum evolution in both closed and open [14, 15], a neural network layer defined by differential quantum systems using only physical observations without equations. Neural ODEs provide the perfect model for specifying the physics a priori. This is in line with physics, since many physical laws are governed by ODEs, treating the quantum system as a black box and the "shut and thus every neural ODE has the correct inductive bias up and calculate" philosophy [34] all the while ignoring built into the model itself.