Proper Orthogonal Decomposition

We evaluate hybrid quantum-classical machine learning for the reduced-order prediction of spatiotemporal brain deformation fields. To mitigate the computational intractability of high-dimensional displacement fields, we employ Proper Orthogonal Decomposition (POD) to project the data into a compact latent space. Within this framework, we formulate two distinct learning objectives: static temporal-to-latent regression and autoregressive latent state forecasting. We systematically benchmark compact classical baselines against both minimal and enhanced hybrid quantum architectures. Our results demonstrate that classical networks provide the strongest baselines in the present setting. For static regression, a classical POD-MLP outperforms all evaluated quantum variants, although an enhanced Variational Quantum Circuit (VQC) substantially improves upon a minimal VQC baseline. For temporal forecasting, a classical POD-LSTM delivers superior predictive accuracy and statistical robustness compared to an enhanced Quantum LSTM (QLSTM) across varying history windows and random initializations. Overall, this study establishes reduced-order physical field learning as a rigorous testbed for near-term QML, highlighting that while hybrid enhancements successfully recover expressivity in weak quantum circuits, classical architectures retain a definitive advantage in both fidelity and stability.

Model-based active flow control requires predictive models that are accurate, stable, and fast enough for real-time optimisation. In controlled wake flows, this is often achieved through Reduced-Order Models (ROMs) that first compress high-dimensional velocity snapshots into a latent space and then learn a time- stepping predictor for the dynamics in the latent space. Here, we study how the choice of the spatial encoder affects the predictability of the resulting latent coordinates for wake flows under control inputs. Using two actuated 2D wake configurations, a simplified truck wake and the fluidic pinball, we compare Proper Orthogonal Decomposition (POD) against nonlinear Convolutional Autoencoders (CAEs) and two types of variational autoencoders for compression, and evaluate several temporal predictors based on Long Short-Term Memory networks. CAEs achieve higher compression efficiency and sharper short-term reconstructions, but they produce latent dynamics that are more irregular and with broadband spectral content. As a consequence, long-horizon forecasts degrade faster and show a higher probability of catastrophic divergence than POD-based models. POD yields smoother latent trajectories that are easier to learn and extrapolate, leading to more reliable predictions beyond the short- term regime. These results reveal a clear trade-off between compactness and forecast accuracy, and suggest that the stability of the latent dynamics prediction can outweigh maximal compression. This is particularly relevant for control strategies rooted in forecasts of the dynamics, such as model predictive control and reinforcement learning. The findings provide practical guidance for designing actuation-aware, hardware-feasible predictive ROMs for real-time flow control.

World models -- compressed latent representations of an environment that support action-conditioned prediction and planning -- are typically presented as a product of modern self-supervised learning. This paper argues that the functional anatomy of a world model was independently developed, deployed, and formally analyzed decades earlier in the model-order-reduction (MOR) and control literature, under different names and for a different purpose: the real-time operation of physical systems. We trace the anatomy across three communities. Low-dimensional models of turbulence built on proper orthogonal decomposition (POD) supplied latent dynamics learned from data of a chaotic environment; eigenface methods in early computer vision supplied the encoder-decoder half, including a primitive runtime validity check; and measurement-based POD frameworks for facility thermal control assembled the complete loop -- POD coefficients as latent state, parametric dependence on actuator setpoints as action conditioning, modal reconstruction as decoding, and, critically, a priori analytical error bounds as a verification layer that certified when the model's predictions could be trusted in closed loop. We then examine what each tradition possesses that the other lacks: MOR contributes verification, physical grounding, and extreme data efficiency; learned world models contribute nonlinear representation, transferability, and horizon. We argue that the outstanding obstacle to deploying world models in systems that cannot fail -- power, thermal, process control -- is not predictive fidelity but verifiability, and we outline a research agenda for physics-grounded, verifiable world models that unifies the two lineages.

Diffusion models enable probabilistic super-resolution and conditional generation, but pixel-space methods are computationally expensive and learned latent spaces often lack interpretable uncertainty quantification. We introduce Patch-PODiff-ViT, a structured latent diffusion framework in which the latent space is defined by patchwise Proper Orthogonal Decomposition (POD), a fixed linear orthonormal basis over local patches, rather than learned by a nonlinear autoencoder. This yields low-dimensional, variance-ordered tokens that preserve spatial structure and enable efficient diffusion in a structured low-dimensional latent space with a Vision Transformer. Because the decoder is fixed, linear, and orthonormal, latent coefficient uncertainty can be propagated directly to physical-space predictive variance, enabling analytic propagation of predictive variance through the linear decoder without Monte Carlo estimation in pixel space. Across sea surface temperature, medical imaging, and natural images, the method achieves strong reconstruction with fewer parameters and lower memory, while producing well-calibrated spatial uncertainty that closely matches empirical ensembles.

We introduce scale-selective Proper Orthogonal Decomposition (POD) for transformer attention fields, inspired by the use of POD for extracting energetically dominant modes from turbulent flow ensembles. The Morlet continuous wavelet transform identifies dominant temporal scales in the attention lag structure across a document ensemble; POD then extracts the energetically dominant modes at each scale from the ensemble of attention fields. The resulting modes reveal layer-dependent scale organisation, with early layers emphasising fine scales and later layers shifting toward coarser scales. We define a spectral concentration index from the POD eigenvalue decay rate and show empirically that it differentiates layers by their attention field complexity. By the classical POD optimality theorem, the extracted modes minimise the average L2 reconstruction error over the ensemble (Theorem 1), giving a data-driven effective rank for each layer. The method requires no architectural modification and no linguistic annotations: dominant attention patterns emerge from ensemble statistics alone. The turbulence analogy is structural rather than physical: we borrow ensemble covariance and modal analysis, not fluid dynamics itself.

High-fidelity computational fluid dynamics (CFD) is widely used for thermal-fluid design, but repeated CFD solves remain expensive for design optimization, uncertainty analysis, and digital-twin workflows. Recently, our team has demonstrated that a proper orthogonal decomposition and neural-network (POD-NN) surrogate can predict two-dimensional thermal fields in an electronics-cooling cold plate with large inference speedups while preserving physically interpretable modal structure. Reproducing and extending such workflows, however, typically requires custom scripts for parameter sampling, Fluent automation, data extraction, reduced-order model construction, neural-network training, validation, and prediction. This paper introduces CFDTwin, an open-source Python package and optional desktop graphical user interface (GUI) that packages these steps into a reusable workflow for ANSYS Fluent simulations. CFDTwin allows users to define simulation inputs and output quantities, generate design-of-experiments samples, run and resume Fluent batch simulations, train POD-NN surrogate models for scalar, surface-field, and cell-zone outputs, inspect validation metrics, and evaluate trained models at new design points without re-running Fluent. The same workflow is exposed through a scriptable Python API and a GUI, supporting reproducible studies, user-facing model validation, and automated design exploration. CFDTwin extends the prior POD-NN modeling study from a case-specific research implementation to a reusable research-software platform for CFD surrogate modeling and digital-twin development.

The convergence of Krylov-based linear iterative solvers applied to parametric partial differential equations (PDEs) is often highly sensitive to the domain, its discretization, the location/values of the applied Dirichlet/Neumann boundary conditions, body forces and material properties, among others. We have previously introduced hybridization of classical linear iterative solvers with neural operators for specific geometries, but they tend to not perform well on geometries not previously seen during training. We partially addressed this challenge by introducing the deep operator network Geo-DeepONet and hybridizing it with Krylov-based iterative linear solvers, which, despite learning effectively across arbitrary unstructured meshes without requiring retraining, led to only modest reductions in iterations compared to state-of-the-art preconditioners. In this study we introduce Neural Subspace Proper Orthogonal Decomposition (NSPOD), a multigrid-like deep operator network-based preconditioner which can dramatically reduce the number of iterations needed for convergence in Krylov-based linear iterative solvers, even when compared to state-of-the-art methods such as algebraic multigrid preconditioners. We demonstrate its efficiency via numerical experiments on a linearized version of solid mechanics PDEs applied to unstructured domains obtained from complex CAD geometries. We expect that the findings in this study lead to more efficient hybrid preconditioners that can match, or possibly even surpass, the convergence properties of the current gold standard preconditioning methods for solid mechanics PDEs.

Probabilistic super-resolution of high-dimensional spatial fields using diffusion models is often computationally prohibitive due to the cost of operating directly in pixel space. We propose PODiff, a structured conditional generative framework that performs diffusion in a fixed, variance-ordered Proper Orthogonal Decomposition (POD) coefficient space, exploiting the orthogonality of POD modes to impose an interpretable, variance-ordered latent geometry. This design enables efficient ensemble generation, preserves dominant spatial structure, and yields spatially interpretable, well-calibrated uncertainty at substantially lower computational cost. We evaluate PODiff on sea surface temperature downscaling over the West Australian coast and on a controlled advection-diffusion benchmark. PODiff achieves reconstruction accuracy comparable to pixel-space diffusion while requiring significantly less memory and producing more reliable uncertainty estimates than deterministic and Monte Carlo Dropout baselines.