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Bulletin of the American Physical Society

Dynamics in correlated quantum matter with neural networks

Markus Schmitt, Markus Heyl

Published Mar 15, 2021• 0 citations
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Neural quantum states provide flexible variational representations of quantum many-body wave functions by combining neural-network parametrizations with Monte Carlo sampling. In this perspective, we review recent advances in their application to condensed-matter systems, focusing on frustrated quantum magnets, interacting lattice fermions, and non-equilibrium dynamics. We discuss the architectures, symmetry constraints, optimization methods, and sampling strategies underlying state-of-the-art calculations, and summarize practical guidelines for reliable simulations. We also examine the principal remaining challenges, including learning non-trivial sign and phase structures, controlling variational bias, enforcing physical symmetries, scaling optimization to large networks, and achieving stable real-time evolution. Finally, we outline promising directions in which neural quantum states may extend the reach of classical simulations of strongly correlated quantum matter.
Understanding the long-time dynamics of strongly correlated quantum matter remains a major challenge: as quantum entanglement grows during time evolution, conventional numerical methods become increasingly costly, limiting access to the long-range correlations and low-energy excitations that govern gapless systems. Here we show that these dynamical correlations can be extended beyond the accessible numerical window without explicitly evolving the underlying many-body wavefunction. We introduce an autoregressive machine-learning framework that enables the extrapolation of dynamical spin correlations in both time and space beyond the reach of conventional numerical methods. Trained on time-dependent density matrix renormalization group simulations of the gapless XXZ model, our approach is benchmarked against exact solutions available for this analytically solvable system. Combined with physics-informed spatial extension, a multi-layer perceptron model using ReLU activation functions has been shown to be superior to convolutional neural networks and linear regressions for longer time extrapolation. A study of error accumulation further demonstrates that our autoregressive neural network extrapolations are highly robust to perturbations, suggesting stable and reliable predictions. This work offers a complementary route to studying the dynamics of gapless quantum many-body systems, in which machine learning extends and complements the capabilities of state-of-the-art numerical approaches.