Archives AI News

Differentiable multiphase flow model for physics-informed machine learning in reservoir pressure management

arXiv:2508.19419v1 Announce Type: new Abstract: Accurate subsurface reservoir pressure control is extremely challenging due to geological heterogeneity and multiphase fluid-flow dynamics. Predicting behavior in this setting relies on high-fidelity physics-based simulations that are computationally expensive. Yet, the uncertain, heterogeneous properties that control these flows make it necessary to perform many of these expensive simulations, which is often prohibitive. To address these challenges, we introduce a physics-informed machine learning workflow that couples a fully differentiable multiphase flow simulator, which is implemented in the DPFEHM framework with a convolutional neural network (CNN). The CNN learns to predict fluid extraction rates from heterogeneous permeability fields to enforce pressure limits at critical reservoir locations. By incorporating transient multiphase flow physics into the training process, our method enables more practical and accurate predictions for realistic injection-extraction scenarios compare to previous works. To speed up training, we pretrain the model on single-phase, steady-state simulations and then fine-tune it on full multiphase scenarios, which dramatically reduces the computational cost. We demonstrate that high-accuracy training can be achieved with fewer than three thousand full-physics multiphase flow simulations -- compared to previous estimates requiring up to ten million. This drastic reduction in the number of simulations is achieved by leveraging transfer learning from much less expensive single-phase simulations.

Generation of Geodesics with Actor-Critic Reinforcement Learning to Predict Midpoints

arXiv:2407.01991v4 Announce Type: replace Abstract: To find the shortest paths for all pairs on manifolds with infinitesimally defined metrics, we introduce a framework to generate them by predicting midpoints recursively. To learn midpoint prediction, we propose an actor-critic approach. We prove the soundness of our approach and show experimentally that the proposed method outperforms existing methods on several planning tasks, including path planning for agents with complex kinematics and motion planning for multi-degree-of-freedom robot arms.

Even Heads Fix Odd Errors: Mechanistic Discovery and Surgical Repair in Transformer Attention

arXiv:2508.19414v1 Announce Type: new Abstract: We present a mechanistic case study of a format-dependent reasoning failure in Llama-3.1-8B-Instruct, where the model incorrectly judges "9.11" as larger than "9.8" in chat or Q&A formats, but answers correctly in simple format. Through systematic intervention, we discover transformers implement even/odd attention head specialization: even indexed heads handle numerical comparison, while odd heads serve incompatible functions. The bug requires exactly 8 even heads at Layer 10 for perfect repair. Any combination of 8+ even heads succeeds, while 7 or fewer completely fails, revealing sharp computational thresholds with perfect redundancy among the 16 even heads. SAE analysis reveals the mechanism: format representations separate (10% feature overlap at Layer 7), then re-entangle with different weightings (80% feature overlap at Layer 10), with specific features showing 1.5x amplification in failing formats. We achieve perfect repair using only 25% of attention heads and identify a 60% pattern replacement threshold, demonstrating that apparent full-module requirements hide sophisticated substructure with implications for interpretability and efficiency. All of our code is available at https://github.com/gussand/surgeon.

Discrete Diffusion VLA: Bringing Discrete Diffusion to Action Decoding in Vision-Language-Action Policies

arXiv:2508.20072v1 Announce Type: cross Abstract: Vision-Language-Action (VLA) models adapt large vision-language backbones to map images and instructions to robot actions. However, prevailing VLA decoders either generate actions autoregressively in a fixed left-to-right order or attach continuous diffusion or flow matching heads outside the backbone, demanding specialized training and iterative sampling that hinder a unified, scalable architecture. We present Discrete Diffusion VLA, a single-transformer policy that models discretized action chunks with discrete diffusion and is trained with the same cross-entropy objective as the VLM backbone. The design retains diffusion's progressive refinement paradigm while remaining natively compatible with the discrete token interface of VLMs. Our method achieves an adaptive decoding order that resolves easy action elements before harder ones and uses secondary remasking to revisit uncertain predictions across refinement rounds, which improves consistency and enables robust error correction. This unified decoder preserves pretrained vision language priors, supports parallel decoding, breaks the autoregressive bottleneck, and reduces the number of function evaluations. Discrete Diffusion VLA achieves 96.3% avg. SR on LIBERO, 71.2% visual matching on SimplerEnv Fractal and 49.3% overall on SimplerEnv Bridge, improving over both autoregressive and continuous diffusion baselines. These findings indicate that discrete-diffusion action decoder supports precise action modeling and consistent training, laying groundwork for scaling VLA to larger models and datasets.

Kolmogorov-Arnold Representation for Symplectic Learning: Advancing Hamiltonian Neural Networks

arXiv:2508.19410v1 Announce Type: new Abstract: We propose a Kolmogorov-Arnold Representation-based Hamiltonian Neural Network (KAR-HNN) that replaces the Multilayer Perceptrons (MLPs) with univariate transformations. While Hamiltonian Neural Networks (HNNs) ensure energy conservation by learning Hamiltonian functions directly from data, existing implementations, often relying on MLPs, cause hypersensitivity to the hyperparameters while exploring complex energy landscapes. Our approach exploits the localized function approximations to better capture high-frequency and multi-scale dynamics, reducing energy drift and improving long-term predictive stability. The networks preserve the symplectic form of Hamiltonian systems, and thus maintain interpretability and physical consistency. After assessing KAR-HNN on four benchmark problems including spring-mass, simple pendulum, two- and three-body problem, we foresee its effectiveness for accurate and stable modeling of realistic physical processes often at high dimensions and with few known parameters.

Vocoder-Projected Feature Discriminator

arXiv:2508.17874v2 Announce Type: replace-cross Abstract: In text-to-speech (TTS) and voice conversion (VC), acoustic features, such as mel spectrograms, are typically used as synthesis or conversion targets owing to their compactness and ease of learning. However, because the ultimate goal is to generate high-quality waveforms, employing a vocoder to convert these features into waveforms and applying adversarial training in the time domain is reasonable. Nevertheless, upsampling the waveform introduces significant time and memory overheads. To address this issue, we propose a vocoder-projected feature discriminator (VPFD), which uses vocoder features for adversarial training. Experiments on diffusion-based VC distillation demonstrated that a pretrained and frozen vocoder feature extractor with a single upsampling step is necessary and sufficient to achieve a VC performance comparable to that of waveform discriminators while reducing the training time and memory consumption by 9.6 and 11.4 times, respectively.

Quantum-Classical Hybrid Molecular Autoencoder for Advancing Classical Decoding

arXiv:2508.19394v1 Announce Type: new Abstract: Although recent advances in quantum machine learning (QML) offer significant potential for enhancing generative models, particularly in molecular design, a large array of classical approaches still face challenges in achieving high fidelity and validity. In particular, the integration of QML with sequence-based tasks, such as Simplified Molecular Input Line Entry System (SMILES) string reconstruction, remains underexplored and usually suffers from fidelity degradation. In this work, we propose a hybrid quantum-classical architecture for SMILES reconstruction that integrates quantum encoding with classical sequence modeling to improve quantum fidelity and classical similarity. Our approach achieves a quantum fidelity of approximately 84% and a classical reconstruction similarity of 60%, surpassing existing quantum baselines. Our work lays a promising foundation for future QML applications, striking a balance between expressive quantum representations and classical sequence models and catalyzing broader research on quantum-aware sequence models for molecular and drug discovery.

General agents contain world models

arXiv:2506.01622v3 Announce Type: replace-cross Abstract: Are world models a necessary ingredient for flexible, goal-directed behaviour, or is model-free learning sufficient? We provide a formal answer to this question, showing that any agent capable of generalizing to multi-step goal-directed tasks must have learned a predictive model of its environment. We show that this model can be extracted from the agent's policy, and that increasing the agents performance or the complexity of the goals it can achieve requires learning increasingly accurate world models. This has a number of consequences: from developing safe and general agents, to bounding agent capabilities in complex environments, and providing new algorithms for eliciting world models from agents.

DETNO: A Diffusion-Enhanced Transformer Neural Operator for Long-Term Traffic Forecasting

arXiv:2508.19389v1 Announce Type: new Abstract: Accurate long-term traffic forecasting remains a critical challenge in intelligent transportation systems, particularly when predicting high-frequency traffic phenomena such as shock waves and congestion boundaries over extended rollout horizons. Neural operators have recently gained attention as promising tools for modeling traffic flow. While effective at learning function space mappings, they inherently produce smooth predictions that fail to reconstruct high-frequency features such as sharp density gradients which results in rapid error accumulation during multi-step rollout predictions essential for real-time traffic management. To address these fundamental limitations, we introduce a unified Diffusion-Enhanced Transformer Neural Operator (DETNO) architecture. DETNO leverages a transformer neural operator with cross-attention mechanisms, providing model expressivity and super-resolution, coupled with a diffusion-based refinement component that iteratively reconstructs high-frequency traffic details through progressive denoising. This overcomes the inherent smoothing limitations and rollout instability of standard neural operators. Through comprehensive evaluation on chaotic traffic datasets, our method demonstrates superior performance in extended rollout predictions compared to traditional and transformer-based neural operators, preserving high-frequency components and improving stability over long prediction horizons.

Which Spaces can be Embedded in $L_p$-type Reproducing Kernel Banach Space? A Characterization via Metric Entropy

arXiv:2410.11116v3 Announce Type: replace-cross Abstract: In this paper, we establish a novel connection between the metric entropy growth and the embeddability of function spaces into reproducing kernel Hilbert/Banach spaces. Metric entropy characterizes the information complexity of function spaces and has implications for their approximability and learnability. Classical results show that embedding a function space into a reproducing kernel Hilbert space (RKHS) implies a bound on its metric entropy growth. Surprisingly, we prove a textbf{converse}: a bound on the metric entropy growth of a function space allows its embedding to a $L_p-$type Reproducing Kernel Banach Space (RKBS). This shows that the ${L}_p-$type RKBS provides a broad modeling framework for learnable function classes with controlled metric entropies. Our results shed new light on the power and limitations of kernel methods for learning complex function spaces.