Sequencing Initial Conditions in Physics-Informed Neural Networks

S. Hooshyar, Arash Elahi
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Abstract

The scientific machine learning (SciML) field has introduced a new class of models called physics-informed neural networks (PINNs). These models incorporate domain-specific knowledge as soft constraints on a loss function and use machine learning techniques to train the model. Although PINN models have shown promising results for simple problems, they are prone to failure when moderate level of complexities are added to the problems. We demonstrate that the existing baseline models, in particular PINN and evolutionary sampling (Evo), are unable to capture the solution to differential equations with convection, reaction, and diffusion operators when the imposed initial condition is non-trivial. We then propose a promising solution to address these types of failure modes. This approach involves coupling Curriculum learning with the baseline models, where the network first trains on PDEs with simple initial conditions and is progressively exposed to more complex initial conditions. Our results show that we can reduce the error by 1 – 2 orders of magnitude with our proposed method compared to regular PINN and Evo.
物理信息神经网络中的初始条件排序
科学机器学习(SciML)领域引入了一类新的模型,称为物理信息神经网络(PINNs)。这些模型将特定领域的知识作为损失函数的软约束,并使用机器学习技术来训练模型。尽管 PINN 模型在处理简单问题时取得了可喜的成果,但当问题的复杂程度达到中等水平时,这些模型就容易失效。我们证明,现有的基线模型,尤其是 PINN 和进化采样(Evo)模型,无法捕捉带有对流、反应和扩散算子的微分方程的解。因此,我们提出了一种很有前景的解决方案来解决这些类型的故障模式。这种方法将课程学习与基线模型结合起来,网络首先在初始条件简单的 PDEs 上进行训练,然后逐步接触更复杂的初始条件。结果表明,与普通 PINN 和 Evo 相比,我们提出的方法可以将误差降低 1 - 2 个数量级。
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Journal of Chemistry and Environment
Journal of Chemistry and Environment Chemistry and Environmental Sciences-
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期刊介绍: Journal of Chemistry and Environment (ISSN: 2959-0132) is a peer-reviewed, open-access international journal that publishes original research and reviews in the fields of chemistry and protecting our environment for the future in an ongoing way. Our central goal is to provide a hub for researchers working across all subjects to present their discoveries, and to be a forum for the discussion of the important issues in the field. All scales of studies and analysis, from impactful fundamental advances in chemistry to interdisciplinary research across physical chemistry, organic chemistry, inorganic chemistry, biochemistry, chemical engineering, and environmental chemistry disciplines are welcomed. All manuscripts must be prepared in English and are subject to a rigorous and fair peer-review process. Accepted papers will appear online within 3 weeks followed by printed hard copies. Note: There are no Article Publication Charges. (100% waived). Welcome to submit your Mini reviews, full reviews, and research articles. Journal of Chemistry and Environment aims to publish high-quality research in the following areas: (Topics include, but are not limited to, the following) • Physical, organic, inorganic & analytical chemistry • Biochemistry & medicinal chemistry • Environmental chemistry & environmental impacts of energy technologies • Chemical physics, material & computational chemistry • Catalysis, electrocatalysis & photocatalysis • Energy, fuel cells & batteries Journal of Chemistry and Environment publishes: • Full papers • Reviews • Minireviews
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