arXiv:2606. 07146v1 Announce Type: new Abstract: Physics-informed machine learning is often assessed by curve error, although engineering use depends on downstream decisions: ranking candidates, avoiding infeasible designs and limiting regret.
arXiv:2606. 28578v1 Announce Type: cross Abstract: Closed-loop materials discovery iterates between proposing candidate structures and evaluating their properties, and property evaluation dominates the cost.
arXiv:2607. 29225v1 Announce Type: new Abstract: Bayesian Optimization (BO) is widely adopted for data-efficient optimization in scientific and engineering applications, yet its computational cost is rarely evaluated alongside optimization performance.
arXiv:2510. 07474v2 Announce Type: replace Abstract: When designing new materials, it is often necessary to design a material with specific desired properties.
PhysicsBench is a unified benchmark and leaderboard that evaluates both generative and predictive AI models for engineering design and simulation under a single standardized procedure. It covers seven generation and prediction tasks across 1D, 2D, and 3D domains, ranking 66 models on nine industrial‑scale CAD/CFD/FEA datasets and public references, expanded into 28 configurations. The evaluation uses realistic, limited data scales and a common metric suite that captures geometric fidelity, physical‑field accuracy, and engineering‑specific validity, with rankings derived via a PageRank‑based dominance graph and a separate efficiency view.
The paper introduces PRISMS, a framework that uses expert pairwise rankings of varying fidelity to curate scientific designs without relying on data-intensive regression models. By escalating queries from lower- to higher-fidelity rankers based on Fisher-information, PRISMS improves discovery recall and reduces the number of screening rounds compared to regression-only and non‑escalated ranking methods. In optimization tasks, PRISMS outperforms Bayesian optimization by achieving higher hypervolume.
arXiv:2607. 13688v1 Announce Type: new Abstract: Emerging sustainable materials increasingly rely on engineered hierarchy and microstructure to achieve control of their properties and mechanical behavior.
arXiv:2608. 01431v1 Announce Type: cross Abstract: Polymer property prediction and inverse generative design targeting desired properties are two crucial tasks in machine learning-assisted polymer design.
arXiv:2607. 07863v1 Announce Type: new Abstract: In physically dominated machining processes, experimental datasets are small, expensive, and material-specific; in this regime, data curation, evaluation design, and the form of physics integration can matter as much as the learning algorithm.
Polymer property prediction and inverse generative design targeting desired properties are two crucial tasks in machine learning-assisted polymer design. While the former has received considerable attention, there have been limited methods developed for the latter.
arXiv:2602. 10392v2 Announce Type: replace Abstract: When designing new materials, it is often necessary to tailor the material design to have some desired properties.
arXiv:2508. 05762v2 Announce Type: replace-cross Abstract: Universal machine learning force fields (UMLFFs) promise to revolutionize materials science by enabling rapid atomistic simulations across the periodic table.
arXiv:2608. 14063v1 Announce Type: new Abstract: Machine learning is rapidly reshaping constitutive modeling, offers new ways to learn material behavior directly from experimental data, and challenges long-established modeling paradigms.