Uncovering Physical Drivers of Dark Matter Halo Structures with Auxiliary-Variable-Guided Generative Models

Galaxy clusters are powerful probes of astrophysics and cosmology through gravitational lensing: the clusters' mass, dominated by 85% dark matter, distorts background light. Yet, mass reconstruction lacks the scalability and large-scale benchmarks to process the hundreds of thousands of clusters expected from forthcoming wide-field surveys. We introduce a fully automated method to reconstruct cluster surface mass density from photometry and gravitational lensing observables. Central to our approach is DarkClusters-15k, our new dataset of 15,000 simulated clusters with paired mass and photometry maps, the largest benchmark to date, spanning multiple redshifts and simulation frameworks. We train a plug-and-play diffusion prior on DarkClusters-15k that learns the statistical relationship between mass and light, and draw posterior samples constrained by weak- and strong-lensing observables; this yields principled reconstructions driven by explicit physics, alongside well-calibrated uncertainties. Our approach requires no expert tuning, runs in minutes rather than hours, achieves higher accuracy, and matches expertly-tuned reconstructions of the MACS 1206 cluster. We release our method and DarkClusters-15k to support development and benchmarking for upcoming wide-field cosmological surveys.

Reconstructing the three-dimensional distribution of dark matter from weak-lensing observations is a central but highly ill-posed inverse problem in cosmology. Unlike standard 3D reconstruction with multiple viewpoints, we observe the universe from a single line of sight, through noisy shape distortions of galaxies with uncertain distances, so meaningful recovery of the 3D matter field requires strong prior assumptions. Existing methods either produce point estimates with handcrafted priors or use neural ensembles for approximate Bayesian uncertainty, and struggle to capture the non-Gaussian, filamentary structure of the cosmic web. With the advent of new high-resolution cosmological simulations, we now have an alternative source of prior knowledge that captures the nonlinear statistics of structure formation with far greater fidelity than analytic prescriptions. We leverage these simulations to build a new dataset $\texttt{Conicus3D}$, which enables us to learn a data-driven diffusion-model prior capturing the full 3D distribution of dark matter structure across cosmic time. Building on recent plug-and-play approaches, we modify a diffusion-based posterior sampling scheme to the 3D weak-lensing setting, combining the learned prior with a differentiable physical forward model. On realistic simulations targeting a modern weak lensing survey, our approach yields substantially improved 2D and 3D reconstruction accuracy over baseline methods. Moreover, it produces posterior samples whose statistics closely track the underlying simulations, while remaining robust to moderate shifts in cosmology.

Learning the compositional nature of the physical world requires joint observation of interacting factors. However, because practical data is often decentralized, these factors are fragmented across isolated silos. Existing decentralized generative approaches focus only on modeling the union of siloed data, overlooking novel combinations implied by the collective whole. To bridge this gap, we introduce Decentralized Compositional Flow Matching (DCFM), a framework that enforces structural constraints across the global set of generative factors, without exchanging any raw data. DCFM enables novel combinations to emerge through peer interactions, even when no single data source can independently support the composition. Empirically, DCFM substantially outperforms federated learning and mixture-of-experts baselines across conditional image generation, robotic spatial planning, and medical attribute co-occurrence modeling.