{"title":"求解偏微分方程的物理信息神经网络中可学习的激活函数","authors":"Afrah Farea, Mustafa Serdar Celebi","doi":"10.1016/j.cpc.2025.109753","DOIUrl":null,"url":null,"abstract":"<div><div>Physics-Informed Neural Networks (PINNs) have emerged as a promising approach for solving Partial Differential Equations (PDEs). However, they face challenges related to spectral bias (the tendency to learn low-frequency components while struggling with high-frequency features) and unstable convergence dynamics (mainly stemming from the multi-objective nature of the PINN loss function). These limitations impact their accuracy for solving problems involving rapid oscillations, sharp gradients, and complex boundary behaviors. We systematically investigate learnable activation functions as a solution to these challenges, comparing Multilayer Perceptrons (MLPs) using fixed and learnable activation functions against Kolmogorov-Arnold Networks (KANs) that employ learnable basis functions. Our evaluation spans diverse PDE types, including linear and non-linear wave problems, mixed-physics systems, and fluid dynamics. Using empirical Neural Tangent Kernel (NTK) analysis and Hessian eigenvalue decomposition, we assess spectral bias and convergence stability of the models. Our results reveal a trade-off between expressivity and training convergence stability. While learnable activation functions work well in simpler architectures, they encounter scalability issues in complex networks due to the higher functional dimensionality. Counterintuitively, we find that low spectral bias alone does not guarantee better accuracy, as functions with broader NTK eigenvalue spectra may exhibit convergence instability. We demonstrate that activation function selection remains inherently problem-specific, with different bases showing distinct advantages for particular PDE characteristics. We believe these insights will help in the design of more robust neural PDE solvers.</div></div>","PeriodicalId":285,"journal":{"name":"Computer Physics Communications","volume":"315 ","pages":"Article 109753"},"PeriodicalIF":7.2000,"publicationDate":"2025-07-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Learnable activation functions in physics-informed neural networks for solving partial differential equations\",\"authors\":\"Afrah Farea, Mustafa Serdar Celebi\",\"doi\":\"10.1016/j.cpc.2025.109753\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>Physics-Informed Neural Networks (PINNs) have emerged as a promising approach for solving Partial Differential Equations (PDEs). However, they face challenges related to spectral bias (the tendency to learn low-frequency components while struggling with high-frequency features) and unstable convergence dynamics (mainly stemming from the multi-objective nature of the PINN loss function). These limitations impact their accuracy for solving problems involving rapid oscillations, sharp gradients, and complex boundary behaviors. We systematically investigate learnable activation functions as a solution to these challenges, comparing Multilayer Perceptrons (MLPs) using fixed and learnable activation functions against Kolmogorov-Arnold Networks (KANs) that employ learnable basis functions. Our evaluation spans diverse PDE types, including linear and non-linear wave problems, mixed-physics systems, and fluid dynamics. Using empirical Neural Tangent Kernel (NTK) analysis and Hessian eigenvalue decomposition, we assess spectral bias and convergence stability of the models. Our results reveal a trade-off between expressivity and training convergence stability. While learnable activation functions work well in simpler architectures, they encounter scalability issues in complex networks due to the higher functional dimensionality. Counterintuitively, we find that low spectral bias alone does not guarantee better accuracy, as functions with broader NTK eigenvalue spectra may exhibit convergence instability. We demonstrate that activation function selection remains inherently problem-specific, with different bases showing distinct advantages for particular PDE characteristics. We believe these insights will help in the design of more robust neural PDE solvers.</div></div>\",\"PeriodicalId\":285,\"journal\":{\"name\":\"Computer Physics Communications\",\"volume\":\"315 \",\"pages\":\"Article 109753\"},\"PeriodicalIF\":7.2000,\"publicationDate\":\"2025-07-15\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Computer Physics Communications\",\"FirstCategoryId\":\"101\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0010465525002553\",\"RegionNum\":2,\"RegionCategory\":\"物理与天体物理\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Computer Physics Communications","FirstCategoryId":"101","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0010465525002553","RegionNum":2,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS","Score":null,"Total":0}
Learnable activation functions in physics-informed neural networks for solving partial differential equations
Physics-Informed Neural Networks (PINNs) have emerged as a promising approach for solving Partial Differential Equations (PDEs). However, they face challenges related to spectral bias (the tendency to learn low-frequency components while struggling with high-frequency features) and unstable convergence dynamics (mainly stemming from the multi-objective nature of the PINN loss function). These limitations impact their accuracy for solving problems involving rapid oscillations, sharp gradients, and complex boundary behaviors. We systematically investigate learnable activation functions as a solution to these challenges, comparing Multilayer Perceptrons (MLPs) using fixed and learnable activation functions against Kolmogorov-Arnold Networks (KANs) that employ learnable basis functions. Our evaluation spans diverse PDE types, including linear and non-linear wave problems, mixed-physics systems, and fluid dynamics. Using empirical Neural Tangent Kernel (NTK) analysis and Hessian eigenvalue decomposition, we assess spectral bias and convergence stability of the models. Our results reveal a trade-off between expressivity and training convergence stability. While learnable activation functions work well in simpler architectures, they encounter scalability issues in complex networks due to the higher functional dimensionality. Counterintuitively, we find that low spectral bias alone does not guarantee better accuracy, as functions with broader NTK eigenvalue spectra may exhibit convergence instability. We demonstrate that activation function selection remains inherently problem-specific, with different bases showing distinct advantages for particular PDE characteristics. We believe these insights will help in the design of more robust neural PDE solvers.
期刊介绍:
The focus of CPC is on contemporary computational methods and techniques and their implementation, the effectiveness of which will normally be evidenced by the author(s) within the context of a substantive problem in physics. Within this setting CPC publishes two types of paper.
Computer Programs in Physics (CPiP)
These papers describe significant computer programs to be archived in the CPC Program Library which is held in the Mendeley Data repository. The submitted software must be covered by an approved open source licence. Papers and associated computer programs that address a problem of contemporary interest in physics that cannot be solved by current software are particularly encouraged.
Computational Physics Papers (CP)
These are research papers in, but are not limited to, the following themes across computational physics and related disciplines.
mathematical and numerical methods and algorithms;
computational models including those associated with the design, control and analysis of experiments; and
algebraic computation.
Each will normally include software implementation and performance details. The software implementation should, ideally, be available via GitHub, Zenodo or an institutional repository.In addition, research papers on the impact of advanced computer architecture and special purpose computers on computing in the physical sciences and software topics related to, and of importance in, the physical sciences may be considered.