system state
Projection-based Lyapunov method for fully heterogeneous weakly-coupled MDPs
Heterogeneity poses a fundamental challenge for many real-world large-scale decision-making problems but remains largely understudied. In this paper, we study the fully heterogeneous setting of a prominent class of such problems, known as weakly-coupled Markov decision processes (WCMDPs). Each WCMDP consists of N arms (or subproblems), which have distinct model parameters in the fully heterogeneous setting, leading to the curse of dimensionality when N is large. We show that, under mild assumptions, an efficiently computable policy achieves an O(1/ N) optimality gap in the long-run average reward per arm for fully heterogeneous WCMDPs as N becomes large. This is the first asymptotic optimality result for fully heterogeneous average-reward WCMDPs. Our main technical innovation is the construction of projection-based Lyapunov functions that certify the convergence of rewards and costs to an optimal region, even under full heterogeneity.1
Appendices
Appendix A provides derivations supporting Section 3 in the main paper. In Appendix B, we explain our experimental setup, including dataset preparation and model implementation, in more detail. Finally, Appendix C provides additional results supporting our claims regarding the scalability of our method, together with additional results from the experiments presented in Section 4. In this section we provide detailed derivations of the ST-DGMRF joint distribution, for both firstorder transition models (Section A.1) and higher-order transition models (Section A.2). A.1 Joint distribution The LDS (see Section 2.2 and 3.1 in the main paper) defines a joint distribution over system states First, note that Eq. (1) can be written as a set of linear equations Moving all xk-terms to the left-hand side, we can rewrite this as a matrix-vector multiplication I F1 I F2 I ...... FKI | {z} Empty positions in F represent zero-blocks. Now, we can express x as an affine transformation of ฯต x = F 1c+F 1ฯต, (3) where F 1 exists because det(F) = 1. Since ฯต is distributed as ฯต N(0,Q 1) with Q = diag(Q0,Q1,...,QK), and c is deterministic, we can use the affine property of Gaussian distributions to obtain the joint distribution This reduces both computations and memory requirements. In contrast, the information vector ฮท = โฆยตcan be expressed compactly as ฮท = FTQFF 1c = FTQc, (8) which can be computed efficiently using sparse and parallel matrix-vector multiplications on a GPU.
P 2 C 2 Net: PDE-Preserved Coarse Correction Network for efficient prediction of spatiotemporal dynamics
When solving partial differential equations (PDEs), classical numerical methods often require fine mesh grids and small time stepping to meet stability, consistency, and convergence conditions, leading to high computational cost. Recently, machine learning has been increasingly utilized to solve PDE problems, but they often encounter challenges related to interpretability, generalizability, and strong dependency on rich labeled data. Hence, we introduce a new PDE-Preserved Coarse Correction Network (P$^2$C$^2$Net) to efficiently solve spatiotemporal PDE problems on coarse mesh grids in small data regimes. The model consists of two synergistic modules: (1) a trainable PDE block that learns to update the coarse solution (i.e., the system state), based on a high-order numerical scheme with boundary condition encoding, and (2) a neural network block that consistently corrects the solution on the fly. In particular, we propose a learnable symmetric Conv filter, with weights shared over the entire model, to accurately estimate the spatial derivatives of PDE based on the neural-corrected system state. The resulting physics-encoded model is capable of handling limited training data (e.g., 3--5 trajectories) and accelerates the prediction of PDE solutions on coarse spatiotemporal grids while maintaining a high accuracy. P$^2$C$^2$Net achieves consistent state-of-the-art performance with over 50\% gain (e.g., in terms of relative prediction error) across four datasets covering complex reaction-diffusion processes and turbulent flows.
Quantifying and Attributing Submodel Uncertainty in Stochastic Simulation Models and Digital Twins
Ghasemloo, Mohammadmahdi, Eckman, David J., Li, Yaxian
Stochastic simulation is widely used to study complex systems composed of various interconnected subprocesses, such as input processes, routing and control logic, optimization routines, and data-driven decision modules. In practice, these subprocesses may be inherently unknown or too computationally intensive to directly embed in the simulation model. Replacing these elements with estimated or learned approximations introduces a form of epistemic uncertainty that we refer to as submodel uncertainty. This paper investigates how submodel uncertainty affects the estimation of system performance metrics. We develop a framework for quantifying submodel uncertainty in stochastic simulation models and extend the framework to digital-twin settings, where simulation experiments are repeatedly conducted with the model initialized from observed system states. Building on approaches from input uncertainty analysis, we leverage bootstrapping and Bayesian model averaging to construct quantile-based confidence or credible intervals for key performance indicators. We propose a tree-based method that decomposes total output variability and attributes uncertainty to individual submodels in the form of importance scores. The proposed framework is model-agnostic and accommodates both parametric and nonparametric submodels under frequentist and Bayesian modeling paradigms. A synthetic numerical experiment and a more realistic digital-twin simulation of a contact center illustrate the importance of understanding how and how much individual submodels contribute to overall uncertainty.
Appendices
Appendix A provides derivations supporting Section 3 in the main paper. In this section we provide detailed derivations of the ST -DGMRF joint distribution, for both first-order transition models (Section A.1) and higher-order transition models (Section A.2). A.1 Joint distribution The LDS (see Section 2.2 and 3.1 in the main paper) defines a joint distribution over system states First, note that Eq. (1) can be written as a set of linear equations x We make use of this property in the DGMRF formulation and in the conjugate gradient method. Eq. 11 is converted into a discrete-time dynamical system by approximating ฯ We consider two ST -DGMRF variants that capture different amounts of prior knowledge. DGMRF transition matrices can be parameterized accordingly. The air quality dataset is based on hourly PM2.5 measurements obtained from [ The raw PM2.5 measurements are log-transformed and standardized to zero mean and unit Ca. 50% of the nodes are masked out (purple nodes within We use a simple MLP with one hidden layer of width 16 with ReLU activations and no output non-linearity. The DGMRF parameters are not shared across time, allowing for dynamically changing spatial covariance patterns.
Dynamical Wasserstein Barycenters for Time-series Modeling
Many time series can be modeled as a sequence of segments representing high-level discrete states, such as running and walking in a human activity application. Flexible models should describe the system state and observations in stationary ``pure-state'' periods as well as transition periods between adjacent segments, such as a gradual slowdown between running and walking. However, most prior work assumes instantaneous transitions between pure discrete states. We propose a dynamical Wasserstein barycentric (DWB) model that estimates the system state over time as well as the data-generating distributions of pure states in an unsupervised manner. Our model assumes each pure state generates data from a multivariate normal distribution, and characterizes transitions between states via displacement-interpolation specified by the Wasserstein barycenter. The system state is represented by a barycentric weight vector which evolves over time via a random walk on the simplex. Parameter learning leverages the natural Riemannian geometry of Gaussian distributions under the Wasserstein distance, which leads to improved convergence speeds. Experiments on several human activity datasets show that our proposed DWB model accurately learns the generating distribution of pure states while improving state estimation for transition periods compared to the commonly used linear interpolation mixture models.
DeepTOP: Deep Threshold-Optimal Policy for MDPs and RMABs
We consider the problem of learning the optimal threshold policy for control problems. Threshold policies make control decisions by evaluating whether an element of the system state exceeds a certain threshold, whose value is determined by other elements of the system state. By leveraging the monotone property of threshold policies, we prove that their policy gradients have a surprisingly simple expression. We use this simple expression to build an off-policy actor-critic algorithm for learning the optimal threshold policy. Simulation results show that our policy significantly outperforms other reinforcement learning algorithms due to its ability to exploit the monotone property.In addition, we show that the Whittle index, a powerful tool for restless multi-armed bandit problems, is equivalent to the optimal threshold policy for an alternative problem. This observation leads to a simple algorithm that finds the Whittle index by learning the optimal threshold policy in the alternative problem. Simulation results show that our algorithm learns the Whittle index much faster than several recent studies that learn the Whittle index through indirect means.
Probabilistic Digital Twin for Misspecified Structural Dynamical Systems via Latent Force Modeling and Bayesian Neural Networks
This work presents a probabilistic digital twin framework for response prediction in dynamical systems governed by misspecified physics. The approach integrates Gaussian Process Latent Force Models (GPLFM) and Bayesian Neural Networks (BNNs) to enable end-to-end uncertainty-aware inference and prediction. In the diagnosis phase, model-form errors (MFEs) are treated as latent input forces to a nominal linear dynamical system and jointly estimated with system states using GPLFM from sensor measurements. A BNN is then trained on posterior samples to learn a probabilistic nonlinear mapping from system states to MFEs, while capturing diagnostic uncertainty. For prognosis, this mapping is used to generate pseudo-measurements, enabling state prediction via Kalman filtering. The framework allows for systematic propagation of uncertainty from diagnosis to prediction, a key capability for trustworthy digital twins. The framework is demonstrated using four nonlinear examples: a single degree of freedom (DOF) oscillator, a multi-DOF system, and two established benchmarks -- the Bouc-Wen hysteretic system and the Silverbox experimental dataset -- highlighting its predictive accuracy and robustness to model misspecification.