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Kriging (or Gaussian process regression) is a popular machine learning method for its flexibility and closed-form prediction expressions. However, one of the key challenges in applying kriging to engineering systems is that the available measurement data is scarce due to the measurement limitations and high sensing costs. On the other hand, physical knowledge of the engineering system is often available and represented in the form of partial differential equations (PDEs). We present in this work a PDE Informed Kriging model (PIK), which introduces PDE information via a set of PDE points and conducts posterior prediction similar to the standard kriging method. The proposed PIK model can incorporate physical knowledge from both linear and nonlinear PDEs. To further improve learning performance, we propose an Active PIK framework (APIK) that designs PDE points to leverage the PDE information based on the PIK model and measurement data. The selected PDE points not only explore the whole input space but also exploit the locations where the PDE information is critical in reducing predictive uncertainty. Finally, an expectation-maximization algorithm is developed for parameter estimation. We demonstrate the effectiveness of APIK in two synthetic examples, a shock wave case study, and a laser heating case study.
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Motivated by recent research on Physics-Informed Neural Networks (PINNs), we make the first attempt to introduce the PINNs for numerical simulation of the elliptic Partial Differential Equations (PDEs) on 3D manifolds. PINNs are one of the deep learning-based techniques. Based on the data and physical models, PINNs introduce the standard feedforward neural networks (NNs) to approximate the solutions to the PDE systems. By using automatic differentiation, the PDEs system could be explicitly encoded into NNs and consequently, the sum of mean squared residuals from PDEs could be minimized with respect to the NN parameters. In this study, the residual in the loss function could be constructed validly by using the automatic differentiation because of the relationship between the surface differential operators $ abla_S/Delta_S$ and the standard Euclidean differential operators $ abla/Delta$. We first consider the unit sphere as surface to investigate the numerical accuracy and convergence of the PINNs with different training example sizes and the depth of the NNs. Another examples are provided with different complex manifolds to verify the robustness of the PINNs.
Recently, researchers have utilized neural networks to accurately solve partial differential equations (PDEs), enabling the mesh-free method for scientific computation. Unfortunately, the network performance drops when encountering a high nonlinearity domain. To improve the generalizability, we introduce the novel approach of employing multi-task learning techniques, the uncertainty-weighting loss and the gradients surgery, in the context of learning PDE solutions. The multi-task scheme exploits the benefits of learning shared representations, controlled by cross-stitch modules, between multiple related PDEs, which are obtainable by varying the PDE parameterization coefficients, to generalize better on the original PDE. Encouraging the network pay closer attention to the high nonlinearity domain regions that are more challenging to learn, we also propose adversarial training for generating supplementary high-loss samples, similarly distributed to the original training distribution. In the experiments, our proposed methods are found to be effective and reduce the error on the unseen data points as compared to the previous approaches in various PDE examples, including high-dimensional stochastic PDEs.
Most simulation schemes for partial differential equations (PDEs) focus on minimizing a simple error norm of a discretized version of a field. This paper takes a fundamentally different approach; the discretized field is interpreted as data providing information about a real physical field that is unknown. This information is sought to be conserved by the scheme as the field evolves in time. Such an information theoretic approach to simulation was pursued before by information field dynamics (IFD). In this paper we work out the theory of IFD for nonlinear PDEs in a noiseless Gaussian approximation. The result is an action that can be minimized to obtain an informationally optimal simulation scheme. It can be brought into a closed form using field operators to calculate the appearing Gaussian integrals. The resulting simulation schemes are tested numerically in two instances for the Burgers equation. Their accuracy surpasses finite-difference schemes on the same resolution. The IFD scheme, however, has to be correctly informed on the subgrid correlation structure. In certain limiting cases we recover well-known simulation schemes like spectral Fourier Galerkin methods. We discuss implications of the approximations made.
Sparse Identification of Nonlinear Dynamics (SINDy) is a method of system discovery that has been shown to successfully recover governing dynamical systems from data (Brunton et al., PNAS, 16; Rudy et al., Sci. Adv. 17). Recently, several groups have independently discovered that the weak formulation provides orders of magnitude better robustness to noise. Here we extend our Weak SINDy (WSINDy) framework introduced in (arXiv:2005.04339) to the setting of partial differential equations (PDEs). The elimination of pointwise derivative approximations via the weak form enables effective machine-precision recovery of model coefficients from noise-free data (i.e. below the tolerance of the simulation scheme) as well as robust identification of PDEs in the large noise regime (with signal-to-noise ratio approaching one in many well-known cases). This is accomplished by discretizing a convolutional weak form of the PDE and exploiting separability of test functions for efficient model identification using the Fast Fourier Transform. The resulting WSINDy algorithm for PDEs has a worst-case computational complexity of $mathcal{O}(N^{D+1}log(N))$ for datasets with $N$ points in each of $D+1$ dimensions (i.e. $mathcal{O}(log(N))$ operations per datapoint). Furthermore, our Fourier-based implementation reveals a connection between robustness to noise and the spectra of test functions, which we utilize in an textit{a priori} selection algorithm for test functions. Finally, we introduce a learning algorithm for the threshold in sequential-thresholding least-squares (STLS) that enables model identification from large libraries, and we utilize scale-invariance at the continuum level to identify PDEs from poorly-scaled datasets. We demonstrate WSINDys robustness, speed and accuracy on several challenging PDEs.
Deep learning-based surrogate modeling is becoming a promising approach for learning and simulating dynamical systems. Deep-learning methods, however, find very challenging learning stiff dynamics. In this paper, we develop DAE-PINN, the first effective deep-learning framework for learning and simulating the solution trajectories of nonlinear differential-algebraic equations (DAE), which present a form of infinite stiffness and describe, for example, the dynamics of power networks. Our DAE-PINN bases its effectiveness on the synergy between implicit Runge-Kutta time-stepping schemes (designed specifically for solving DAEs) and physics-informed neural networks (PINN) (deep neural networks that we train to satisfy the dynamics of the underlying problem). Furthermore, our framework (i) enforces the neural network to satisfy the DAEs as (approximate) hard constraints using a penalty-based method and (ii) enables simulating DAEs for long-time horizons. We showcase the effectiveness and accuracy of DAE-PINN by learning and simulating the solution trajectories of a three-bus power network.
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