arXiv:2605.20416cs.LGphysics.comp-ph2026-05被引 1

用晶体学指数让AI理解断裂面几何,还能判断是否适用。

Miller-Index-Based Latent Crystallographic Fracture Plane Reasoning and generation with Vision-Language Models

论文配图:Miller-Index-Based Latent Crystallographic Fracture Plane Reasoning and generation with Vision-Language Models
图 1 · 摘自论文原文
  • 将晶面指数作为隐变量,让多模态模型推理断裂面形态。
  • 在真实和合成数据上,模型能准确推断理想断裂面并拒绝不适用情况。
  • 适合材料物理建模与跨模态生成研究者使用。

我们研究多模态大语言模型(MLLMs)能否利用晶体学平面指数(米勒指数)作为结构化隐变量,来推理断裂几何。将米勒指数 $z = (h,k,l)$ 视为控制理想平面断裂的隐变量,评估两种能力:(i) 隐变量推断,即模型在物理合理条件下从视觉观测映射到平面假设;(ii) 隐变量适用性评估,即判断该表示对给定断裂图像是否有意义。通过涵盖合成数据、可控2D-3D几何对及多种材料类别(陶瓷、玻璃、金属、混凝土)的真实断裂图像的广泛实验,结果表明MLLMs在理想场景下可可靠进行隐变量推断,并能有效拒绝不满足物理条件的情况。作为探索性延伸,我们还考察了AI生成的断裂序列,观察到定性合理的脆性断裂演化行为,暗示多模态生成模型可能隐含部分与材料失效动力学相关的先验知识。这些结果表明,只要显式建模有效域,MLLMs可作为基于结构化隐先验的物理感知推理系统。

原文摘要 · Abstract (English)

We study whether multimodal large language models (MLLMs) can leverage crystallographic plane indices (Miller indices) as a structured latent representation for reasoning about fracture geometry. We formulate Miller indices $z = (h,k,l)$ as a latent variable governing idealized planar fracture and evaluate two complementary capabilities: (i) latent inference, where the model maps visual observations to plane hypotheses under physically valid conditions, and (ii) latent applicability assessment, where the model determines whether such a representation is meaningful for a given fracture image. Through extensive experiments spanning synthetic data, controlled 2D--3D geometric pairs, and real-world fracture images across multiple material classes -- including ceramics, glass, metals, and concrete -- we show that MLLMs can reliably perform latent inference in idealized settings and, critically, can reject the latent representation when the underlying physics does not support it. As an exploratory extension, we further examine AI-generated fracture sequences and observe qualitatively plausible brittle-fracture progression behaviors, suggesting that multimodal generative models may encode partial implicit physical priors related to material failure dynamics. These results suggest that MLLMs can act as physics-aware reasoning systems conditioned on structured latent priors, provided that the domain of validity is explicitly modeled.

材料科学多模态模型物理推理

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