基于物理的图形神经网络用于预测无序纤维材料的变形
Shuo Yang1,2, Yunhao Yang1, Chen Huang2
1State Key Laboratory of Molecular Engineering of Polymers, Research Center of AI for Polymer Science, Department of Macromolecular Science, Fudan University, Shanghai 200433, China.
Nano letters
|December 26, 2025
概括
我们开发了一种新的图形学习方法,网络力学预测 (GNMP),以准确高效地建模无序纤维网络的机械行为,从而实现更快的材料设计.
科学领域:
- 材料科学 材料科学 材料科学
- 计算力学 计算力学 计算力学
- 机器学习 机器学习
背景情况:
- 无序的纤维网络在许多应用中至关重要,但由于复杂的变形,其模型具有挑战性.
- 现有的方法在这些网络中与稀疏的连接和非精细的重排作斗争.
研究的目的:
- 引入一种新的基于物理的图形学习方法,用于预测二维半灵活网络的机械反应.
- 与传统的模拟技术相比,实现高精度和显著的效率提升.
主要方法:
- 开发了网络机制预测 (GNMP),这是一个集成图形注意力传递和多尺度物理嵌入的图形学习模型.
- 整合了一种以债券长度为指导的调度器,以有效地捕捉非affine重排.
- 通过对3D打印网络进行实验和控制的波桑比率验证了GNMP.
主要成果:
- GNMP在预测变形和应力应变反应方面表现出可靠的准确性.
- 与分子动力学模拟相比,实现了超过10倍的效率提高.
- 实验验证显示了一致的变形模式和缩短的几何-推理时间.
结论:
- GNMP为纤维材料中的快速,拓意识的机械预测提供了一个可泛化的框架.
- 这种方法加速了仿生软组织,柔性导体和其他基于网络的系统的设计.
相关概念视频
Plastic Deformations
394
Plastic deformation represents a fundamental concept in materials science, which explains the irreversible change in the shape of a material when it experiences stress beyond its elastic capability. This phenomenon is important in structural engineering, especially in designing and analyzing cantilever beams—structures that are securely fixed at one end and bear loads at the opposite end. When these beams are subjected to loads within their elastic range, they will return to their...
394
Plastic Deformations
374
It is essential to understand how structural members behave under plastic deformation when the bending stress exceeds the material's yield strength. This state of deformation permanently alters the shape of the member, in contrast to the linear elastic behavior observed before yielding. The strain at any point in the member is expressed in terms of maximum strain. Notably, the neutral axis, which coincides with the centroid during elastic bending, shifts away from the centroid under plastic...
374
Relation between Poisson's ratio, Modulus of Elasticity and Modulus of Rigidity
522
Deformation occurs in axial and transverse directions when an axial load is applied to a slender bar. This deformation impacts the cubic element within the bar, transforming it into either a rectangular parallelepiped or a rhombus, contingent on its orientation. This transformation process induces shearing strain. Axial loading elicits both shearing and normal strains. Applying an axial load instigates equal normal and shearing stresses on elements oriented at a 45° angle to the load axis.
522
Deformation of Member under Multiple Loadings
422
When a rod is made of different materials or has various cross-sections, it must be divided into parts that meet the necessary conditions for determining the deformation. These parts are each characterized by their internal force, cross-sectional area, length, and modulus of elasticity. These parameters are then used to compute the deformation of the entire rod.
In the case of a member with a variable cross-section, the strain is not constant but depends on the position. The deformation of an...
In the case of a member with a variable cross-section, the strain is not constant but depends on the position. The deformation of an...
422
Plastic Behavior
494
A material's elastic behavior is characterized by the disappearance of stress once the load is removed, allowing the material to return to its original state. However, when stress surpasses the yield point, yielding commences, marking the onset of plastic deformation or permanent set. This change from elastic to plastic behavior is influenced by the peak stress value and the duration before the load is removed. An intriguing observation occurs when a specimen is loaded, unloaded, and...
494
Temperature Dependent Deformation
343
In a nonhomogeneous rod made up of steel and brass, restrained at both ends and subjected to a temperature change, several steps are involved in calculating the stress and compressive load. Due to the problem's static indeterminacy, one end support is disconnected, allowing the rod to experience the temperature change freely. Next, an unknown force is applied at the free end, triggering deformations in the rod's steel and brass portions. These deformations are then calculated and added...
343


