Learning thermodynamic master equations for open quantum systems
Authors: Peter Sentz, Stanley Nicholson, Yujin Cho, Sohail Reddy, Brendan Keith, Stefanie Günther
Organizations: Department of Data and Decision Sciences, Emory University, Atlanta, GA 30322 · 2Division of Applied Mathematics, Brown University, Providence, RI 02912 · 3Lawrence Livermore National Laboratory, Livermore, CA 94550
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 variety of ways, including by modeling with deep neural networks. However, the majority of mathematical models describing open quantum systems are linear, and the natural nonlinearities in learnable models have not been incorporated using physical principles. We present a data-driven model for open quantum systems that includes learnable, thermodynamically consistent terms. The trained model is interpretable, as it directly estimates the system Hamiltonian and linear components of coupling to the environment. We validate the model on synthetic two and three-level data, as well as experimental two-level data collected from a quantum device at Lawrence Livermore National Laboratory.
We design an algorithm for learning the coefficients of an n-qubit constant-local Lindbladian to ε error with O(gd2log(n)/ε2) total evolution time, where g is the single-site energy and d is the (approximate) degree of the interaction graph. Though Lindbladians present new challenges not present in the special case of Hamiltonians, our algorithm achieves the suite of desiderata attained by state-of-the-art Hamiltonian learning algorithms: (1) it uses non-adaptive, ancilla-free randomized Pauli measurement circuits with a time resolution of only Θ(1/g); (2) it works without knowledge of the structure of the unknown Lindbladian; (3) it depends on a smooth form of degree, thereby supporting the learning of quasi-local and power-law Lindbladians. Our algorithm is a simple iterative method, where the objective function consists of Fourier coefficients of the Lindbladian restricted to few-site regions. Its analysis identifies the difficulty unique to open systems, which we call "confusing" terms. For settings where the "confusion" is limited, the performance of the algorithm improves. We demonstrate this for the case of structure learning of Hamiltonians from access to real-time evolution, where we obtain a new algorithm that is significantly simpler than previous work. In addition, using the same iterative method, we design the first efficient algorithm for structure learning Hamiltonians from high-temperature Gibbs states.
Recent theoretical progress has established conditions under which machine learning models can efficiently predict ground-state properties of gapped local Hamiltonians when trained on quantum-generated data. Previous experimental demonstrations in this paradigm, however, have largely been limited to small systems or highly structured states, due to the difficulty of preparing many-body ground states on quantum processors. In this work, we demonstrate learning from experimental quantum data generated from approximate ground states of the two-dimensional Heisenberg XXZ model with system sizes up to 115 qubits. We construct a dataset of single-site expectation values, two-point correlations, and 12-body loop correlations across the antiferromagnetic phase. We then train neural networks on this data and show that they can accurately predict spatially resolved observables for previously unseen Hamiltonian parameters, both within the training distribution and in an out-of-distribution regime approaching the phase boundary. Our results demonstrate the practical realization of learning from quantum data for an interacting two-dimensional many-body system at scale, motivating a path toward regimes where quantum processors could provide training data beyond the reach of classical approximation methods.
Interactive Quantum Classifiers (IQCs) constitute a family of quantum machine learning models inspired by open quantum systems, in which the interaction between a target qubit and an environment is described by a Hamiltonian. Previous works introduced alternative Hamiltonian parameterizations and showed empirically that they can improve classification performance, but the role of these parameters in the resulting classifier remains poorly understood. In this work, we derive a closed-form expression for the reduced quantum channel generated by a parametrized IQC with a single target qubit. The analytical solution explicitly reveals how the Hamiltonian parameters control the constant, sine, and cosine components of the classifier output, establishing a Fourier interpretation of the induced feature map. This analysis motivates a generalized family of Hamiltonian encodings, including matrix-parameterized environmental Hamiltonians whose Fourier components depend on linear combinations of input features, thereby enabling non-separable Fourier structures. Numerical experiments on synthetic and real-world datasets show that the proposed models can improve classification performance on several nonlinear benchmarks. The generalized matrix encoding achieves the strongest aggregate performance in the evaluated benchmark, while a simpler four-parameter extension often attains comparable performance with substantially fewer trainable parameters. We additionally characterize the generated state ensembles using the standard fidelity-based expressibility measure, finding that global expressibility does not directly predict classification performance. Our results provide an analytical characterization of parametrized Hamiltonians in Interactive Quantum Classifiers and establish Fourier analysis as a useful framework for understanding and designing open-system-inspired quantum learning models.
Fábio Novaes, Fernando M. de Paula Neto, João V. M. Cardoso