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Dongxiao Zhang

Publications and source records attributed to Dongxiao Zhang.

72 records · Page 4Linked to original sources

Robust discovery of partial differential equations in complex situations

Data-driven discovery of partial differential equations (PDEs) has achieved considerable development in recent years. Several aspects of problems have been resolved by sparse regression-based and neural network-based methods. However, the performances of existing methods lack stability when dealing with complex situations, including sparse data with high noise, high-order derivatives and shock waves, which bring obstacles to calculating derivatives accurately. Therefore, a robust PDE discovery framework, called the robust deep learning-genetic algorithm (R-DLGA), that incorporates the physics-informed neural network (PINN), is proposed in this work. In the framework, a preliminary result of potential terms provided by the deep learning-genetic algorithm is added into the loss function of the PINN as physical constraints to improve the accuracy of derivative calculation. It assists to optimize the preliminary result and obtain the ultimately discovered PDE by eliminating the error compensation terms. The stability and accuracy of the proposed R-DLGA in several complex situations are examined for proof-and-concept, and the results prove that the proposed framework is able to calculate derivatives accurately with the optimization of PINN and possesses surprising robustness to complex situations, including sparse data with high noise, high-order derivatives, and shock waves.

cs.LG↗

Theory-guided hard constraint projection (HCP): a knowledge-based data-driven scientific machine learning method

Machine learning models have been successfully used in many scientific and engineering fields. However, it remains difficult for a model to simultaneously utilize domain knowledge and experimental observation data. The application of knowledge-based symbolic AI represented by an expert system is limited by the expressive ability of the model, and data-driven connectionism AI represented by neural networks is prone to produce predictions that violate physical mechanisms. In order to fully integrate domain knowledge with observations, and make full use of the prior information and the strong fitting ability of neural networks, this study proposes theory-guided hard constraint projection (HCP). This model converts physical constraints, such as governing equations, into a form that is easy to handle through discretization, and then implements hard constraint optimization through projection. Based on rigorous mathematical proofs, theory-guided HCP can ensure that model predictions strictly conform to physical mechanisms in the constraint patch. The performance of the theory-guided HCP is verified by experiments based on the heterogeneous subsurface flow problem. Due to the application of hard constraints, compared with fully connected neural networks and soft constraint models, such as theory-guided neural networks and physics-informed neural networks, theory-guided HCP requires fewer data, and achieves higher prediction accuracy and stronger robustness to noisy observations.

cs.LG↗

Deep-learning based discovery of partial differential equations in integral form from sparse and noisy data

Data-driven discovery of partial differential equations (PDEs) has attracted increasing attention in recent years. Although significant progress has been made, certain unresolved issues remain. For example, for PDEs with high-order derivatives, the performance of existing methods is unsatisfactory, especially when the data are sparse and noisy. It is also difficult to discover heterogeneous parametric PDEs where heterogeneous parameters are embedded in the partial differential operators. In this work, a new framework combining deep-learning and integral form is proposed to handle the above-mentioned problems simultaneously, and improve the accuracy and stability of PDE discovery. In the framework, a deep neural network is firstly trained with observation data to generate meta-data and calculate derivatives. Then, a unified integral form is defined, and the genetic algorithm is employed to discover the best structure. Finally, the value of parameters is calculated, and whether the parameters are constants or variables is identified. Numerical experiments proved that our proposed algorithm is more robust to noise and more accurate compared with existing methods due to the utilization of integral form. Our proposed algorithm is also able to discover PDEs with high-order derivatives or heterogeneous parameters accurately with sparse and noisy data.

cs.LG↗

Theory-guided Auto-Encoder for Surrogate Construction and Inverse Modeling

A Theory-guided Auto-Encoder (TgAE) framework is proposed for surrogate construction and is further used for uncertainty quantification and inverse modeling tasks. The framework is built based on the Auto-Encoder (or Encoder-Decoder) architecture of convolutional neural network (CNN) via a theory-guided training process. In order to achieve the theory-guided training, the governing equations of the studied problems can be discretized and the finite difference scheme of the equations can be embedded into the training of CNN. The residual of the discretized governing equations as well as the data mismatch constitute the loss function of the TgAE. The trained TgAE can be used to construct a surrogate that approximates the relationship between the model parameters and responses with limited labeled data. In order to test the performance of the TgAE, several subsurface flow cases are introduced. The results show the satisfactory accuracy of the TgAE surrogate and efficiency of uncertainty quantification tasks can be improved with the TgAE surrogate. The TgAE also shows good extrapolation ability for cases with different correlation lengths and variances. Furthermore, the parameter inversion task has been implemented with the TgAE surrogate and satisfactory results can be obtained.

cs.LG↗

Ensemble long short-term memory (EnLSTM) network

In this study, we propose an ensemble long short-term memory (EnLSTM) network, which can be trained on a small dataset and process sequential data. The EnLSTM is built by combining the ensemble neural network (ENN) and the cascaded long short-term memory (C-LSTM) network to leverage their complementary strengths. In order to resolve the issues of over-convergence and disturbance compensation associated with training failure owing to the nature of small-data problems, model parameter perturbation and high-fidelity observation perturbation methods are introduced. The EnLSTM is compared with commonly-used models on a published dataset, and proven to be the state-of-the-art model in generating well logs with a mean-square-error (MSE) reduction of 34%. In the case study, 12 well logs that cannot be measured while drilling are generated based on logging-while-drilling (LWD) data. The EnLSTM is capable to reduce cost and save time in practice.

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Weak Form Theory-guided Neural Network (TgNN-wf) for Deep Learning of Subsurface Single and Two-phase Flow

Deep neural networks (DNNs) are widely used as surrogate models in geophysical applications; incorporating theoretical guidance into DNNs has improved the generalizability. However, most of such approaches define the loss function based on the strong form of conservation laws (via partial differential equations, PDEs), which is subject to deteriorated accuracy when the PDE has high order derivatives or the solution has strong discontinuities. Herein, we propose a weak form theory-guided neural network (TgNN-wf), which incorporates the weak form formulation of the PDE into the loss function combined with data constraint and initial and boundary conditions regularizations to tackle the aforementioned difficulties. In the weak form, high order derivatives in the PDE can be transferred to the test functions by performing integration-by-parts, which reduces computational error. We use domain decomposition with locally defined test functions, which captures local discontinuity effectively. Two numerical cases demonstrate the superiority of the proposed TgNN-wf over the strong form TgNN, including the hydraulic head prediction for unsteady-state 2D single-phase flow problems and the saturation profile prediction for 1D two-phase flow problems. Results show that TgNN-wf consistently has higher accuracy than TgNN, especially when strong discontinuity in the solution is present. TgNN-wf also trains faster than TgNN when the number of integration subdomains is not too large (<10,000). Moreover, TgNN-wf is more robust to noises. Thus, the proposed TgNN-wf paves the way for which a variety of deep learning problems in the small data regime can be solved more accurately and efficiently.

cs.LG↗

A Lagrangian Dual-based Theory-guided Deep Neural Network

The theory-guided neural network (TgNN) is a kind of method which improves the effectiveness and efficiency of neural network architectures by incorporating scientific knowledge or physical information. Despite its great success, the theory-guided (deep) neural network possesses certain limits when maintaining a tradeoff between training data and domain knowledge during the training process. In this paper, the Lagrangian dual-based TgNN (TgNN-LD) is proposed to improve the effectiveness of TgNN. We convert the original loss function into a constrained form with fewer items, in which partial differential equations (PDEs), engineering controls (ECs), and expert knowledge (EK) are regarded as constraints, with one Lagrangian variable per constraint. These Lagrangian variables are incorporated to achieve an equitable tradeoff between observation data and corresponding constraints, in order to improve prediction accuracy, and conserve time and computational resources adjusted by an ad-hoc procedure. To investigate the performance of the proposed method, the original TgNN model with a set of optimized weight values adjusted by ad-hoc procedures is compared on a subsurface flow problem, with their L2 error, R square (R2), and computational time being analyzed. Experimental results demonstrate the superiority of the Lagrangian dual-based TgNN.

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Deep-Learning based Inverse Modeling Approaches: A Subsurface Flow Example

Deep-learning has achieved good performance and shown great potential for solving forward and inverse problems. In this work, two categories of innovative deep-learning based inverse modeling methods are proposed and compared. The first category is deep-learning surrogate-based inversion methods, in which the Theory-guided Neural Network (TgNN) is constructed as a deep-learning surrogate for problems with uncertain model parameters. By incorporating physical laws and other constraints, the TgNN surrogate can be constructed with limited simulation runs and accelerate the inversion process significantly. Three TgNN surrogate-based inversion methods are proposed, including the gradient method, the iterative ensemble smoother (IES), and the training method. The second category is direct-deep-learning-inversion methods, in which TgNN constrained with geostatistical information, named TgNN-geo, is proposed for direct inverse modeling. In TgNN-geo, two neural networks are introduced to approximate the respective random model parameters and the solution. Since the prior geostatistical information can be incorporated, the direct-inversion method based on TgNN-geo works well, even in cases with sparse spatial measurements or imprecise prior statistics. Although the proposed deep-learning based inverse modeling methods are general in nature, and thus applicable to a wide variety of problems, they are tested with several subsurface flow problems. It is found that satisfactory results are obtained with a high efficiency. Moreover, both the advantages and disadvantages are further analyzed for the proposed two categories of deep-learning based inversion methods.

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Deep Learning of Dynamic Subsurface Flow via Theory-guided Generative Adversarial Network

Generative adversarial network (GAN) has been shown to be useful in various applications, such as image recognition, text processing and scientific computing, due its strong ability to learn complex data distributions. In this study, a theory-guided generative adversarial network (TgGAN) is proposed to solve dynamic partial differential equations (PDEs). Different from standard GANs, the training term is no longer the true data and the generated data, but rather their residuals. In addition, such theories as governing equations, other physical constraints and engineering controls, are encoded into the loss function of the generator to ensure that the prediction does not only honor the training data, but also obey these theories. TgGAN is proposed for dynamic subsurface flow with heterogeneous model parameters, and the data at each time step are treated as a two-dimensional image. In this study, several numerical cases are introduced to test the performance of the TgGAN. Predicting the future response, label-free learning and learning from noisy data can be realized easily by the TgGAN model. The effects of the number of training data and the collocation points are also discussed. In order to improve the efficiency of TgGAN, the transfer learning algorithm is also employed. Numerical results demonstrate that the TgGAN model is robust and reliable for deep learning of dynamic PDEs.

physics.geo-ph↗

Deep-learning of Parametric Partial Differential Equations from Sparse and Noisy Data

Data-driven methods have recently made great progress in the discovery of partial differential equations (PDEs) from spatial-temporal data. However, several challenges remain to be solved, including sparse noisy data, incomplete candidate library, and spatially- or temporally-varying coefficients. In this work, a new framework, which combines neural network, genetic algorithm and adaptive methods, is put forward to address all of these challenges simultaneously. In the framework, a trained neural network is utilized to calculate derivatives and generate a large amount of meta-data, which solves the problem of sparse noisy data. Next, genetic algorithm is utilized to discover the form of PDEs and corresponding coefficients with an incomplete candidate library. Finally, a two-step adaptive method is introduced to discover parametric PDEs with spatially- or temporally-varying coefficients. In this method, the structure of a parametric PDE is first discovered, and then the general form of varying coefficients is identified. The proposed algorithm is tested on the Burgers equation, the convection-diffusion equation, the wave equation, and the KdV equation. The results demonstrate that this method is robust to sparse and noisy data, and is able to discover parametric PDEs with an incomplete candidate library.

physics.comp-ph↗

Physics-constrained indirect supervised learning

This study proposes a supervised learning method that does not rely on labels. We use variables associated with the label as indirect labels, and construct an indirect physics-constrained loss based on the physical mechanism to train the model. In the training process, the model prediction is mapped to the space of value that conforms to the physical mechanism through the projection matrix, and then the model is trained based on the indirect labels. The final prediction result of the model conforms to the physical mechanism between indirect label and label, and also meets the constraints of the indirect label. The present study also develops projection matrix normalization and prediction covariance analysis to ensure that the model can be fully trained. Finally, the effect of the physics-constrained indirect supervised learning is verified based on a well log generation problem.

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Efficient Uncertainty Quantification for Dynamic Subsurface Flow with Surrogate by Theory-guided Neural Network

Subsurface flow problems usually involve some degree of uncertainty. Consequently, uncertainty quantification is commonly necessary for subsurface flow prediction. In this work, we propose a methodology for efficient uncertainty quantification for dynamic subsurface flow with a surrogate constructed by the Theory-guided Neural Network (TgNN). The TgNN here is specially designed for problems with stochastic parameters. In the TgNN, stochastic parameters, time and location comprise the input of the neural network, while the quantity of interest is the output. The neural network is trained with available simulation data, while being simultaneously guided by theory (e.g., the governing equation, boundary conditions, initial conditions, etc.) of the underlying problem. The trained neural network can predict solutions of subsurface flow problems with new stochastic parameters. With the TgNN surrogate, the Monte Carlo (MC) method can be efficiently implemented for uncertainty quantification. The proposed methodology is evaluated with two-dimensional dynamic saturated flow problems in porous medium. Numerical results show that the TgNN based surrogate can significantly improve the efficiency of uncertainty quantification tasks compared with simulation based implementation. Further investigations regarding stochastic fields with smaller correlation length, larger variance, changing boundary values and out-of-distribution variances are performed, and satisfactory results are obtained.

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DL-PDE: Deep-learning based data-driven discovery of partial differential equations from discrete and noisy data

In recent years, data-driven methods have been developed to learn dynamical systems and partial differential equations (PDE). The goal of such work is discovering unknown physics and the corresponding equations. However, prior to achieving this goal, major challenges remain to be resolved, including learning PDE under noisy data and limited discrete data. To overcome these challenges, in this work, a deep-learning based data-driven method, called DL-PDE, is developed to discover the governing PDEs of underlying physical processes. The DL-PDE method combines deep learning via neural networks and data-driven discovery of PDE via sparse regressions. In the DL-PDE, a neural network is first trained, and then a large amount of meta-data is generated, and the required derivatives are calculated by automatic differentiation. Finally, the form of PDE is discovered by sparse regression. The proposed method is tested with physical processes, governed by groundwater flow equation, convection-diffusion equation, Burgers equation and Korteweg-de Vries (KdV) equation, for proof-of-concept and applications in real-world engineering settings. The proposed method achieves satisfactory results when data are noisy and limited.

stat.ML↗

DLGA-PDE: Discovery of PDEs with incomplete candidate library via combination of deep learning and genetic algorithm

Data-driven methods have recently been developed to discover underlying partial differential equations (PDEs) of physical problems. However, for these methods, a complete candidate library of potential terms in a PDE are usually required. To overcome this limitation, we propose a novel framework combining deep learning and genetic algorithm, called DLGA-PDE, for discovering PDEs. In the proposed framework, a deep neural network that is trained with available data of a physical problem is utilized to generate meta-data and calculate derivatives, and the genetic algorithm is then employed to discover the underlying PDE. Owing to the merits of the genetic algorithm, such as mutation and crossover, DLGA-PDE can work with an incomplete candidate library. The proposed DLGA-PDE is tested for discovery of the Korteweg-de Vries (KdV) equation, the Burgers equation, the wave equation, and the Chaffee-Infante equation, respectively, for proof-of-concept. Satisfactory results are obtained without the need for a complete candidate library, even in the presence of noisy and limited data.

cs.NE↗

Deep Learning of Subsurface Flow via Theory-guided Neural Network

Active researches are currently being performed to incorporate the wealth of scientific knowledge into data-driven approaches (e.g., neural networks) in order to improve the latter's effectiveness. In this study, the Theory-guided Neural Network (TgNN) is proposed for deep learning of subsurface flow. In the TgNN, as supervised learning, the neural network is trained with available observations or simulation data while being simultaneously guided by theory (e.g., governing equations, other physical constraints, engineering controls, and expert knowledge) of the underlying problem. The TgNN can achieve higher accuracy than the ordinary Artificial Neural Network (ANN) because the former provides physically feasible predictions and can be more readily generalized beyond the regimes covered with the training data. Furthermore, the TgNN model is proposed for subsurface flow with heterogeneous model parameters. Several numerical cases of two-dimensional transient saturated flow are introduced to test the performance of the TgNN. In the learning process, the loss function contains data mismatch, as well as PDE constraint, engineering control, and expert knowledge. After obtaining the parameters of the neural network by minimizing the loss function, a TgNN model is built that not only fits the data, but also adheres to physical/engineering constraints. Predicting the future response can be easily realized by the TgNN model. In addition, the TgNN model is tested in more complicated scenarios, such as prediction with changed boundary conditions, learning from noisy data or outliers, transfer learning, and engineering controls. Numerical results demonstrate that the TgNN model achieves much better predictability, reliability, and generalizability than ANN models due to the physical/engineering constraints in the former.

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Ensemble Neural Networks (ENN): A gradient-free stochastic method

In this study, an efficient stochastic gradient-free method, the ensemble neural networks (ENN), is developed. In the ENN, the optimization process relies on covariance matrices rather than derivatives. The covariance matrices are calculated by the ensemble randomized maximum likelihood algorithm (EnRML), which is an inverse modeling method. The ENN is able to simultaneously provide estimations and perform uncertainty quantification since it is built under the Bayesian framework. The ENN is also robust to small training data size because the ensemble of stochastic realizations essentially enlarges the training dataset. This constitutes a desirable characteristic, especially for real-world engineering applications. In addition, the ENN does not require the calculation of gradients, which enables the use of complicated neuron models and loss functions in neural networks. We experimentally demonstrate benefits of the proposed model, in particular showing that the ENN performs much better than the traditional Bayesian neural networks (BNN). The EnRML in ENN is a substitution of gradient-based optimization algorithms, which means that it can be directly combined with the feed-forward process in other existing (deep) neural networks, such as convolutional neural networks (CNN) and recurrent neural networks (RNN), broadening future applications of the ENN.

stat.ML↗

Identification of physical processes via combined data-driven and data-assimilation methods

With the advent of modern data collection and storage technologies, data-driven approaches have been developed for discovering the governing partial differential equations (PDE) of physical problems. However, in the extant works the model parameters in the equations are either assumed to be known or have a linear dependency. Therefore, most of the realistic physical processes cannot be identified with the current data-driven PDE discovery approaches. In this study, an innovative framework is developed that combines data-driven and data-assimilation methods for simultaneously identifying physical processes and inferring model parameters. Spatiotemporal measurement data are first divided into a training data set and a testing data set. Using the training data set, a data-driven method is developed to learn the governing equation of the considered physical problem by identifying the occurred (or dominated) processes and selecting the proper empirical model. Through introducing a prediction error of the learned governing equation for the testing data set, a data-assimilation method is devised to estimate the uncertain model parameters of the selected empirical model. For the contaminant transport problem investigated, the results demonstrate that the proposed method can adequately identify the considered physical processes via concurrently discovering the corresponding governing equations and inferring uncertain parameters of nonlinear models, even in the presence of measurement errors. This work helps to broaden the applicable area of the research of data driven discovery of governing equations of physical problems.

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An adsorbed gas estimation model for shale gas reservoirs via statistical learning

Shale gas plays an important role in reducing pollution and adjusting the structure of world energy. Gas content estimation is particularly significant in shale gas resource evaluation. There exist various estimation methods, such as first principle methods and empirical models. However, resource evaluation presents many challenges, especially the insufficient accuracy of existing models and the high cost resulting from time-consuming adsorption experiments. In this research, a low-cost and high-accuracy model based on geological parameters is constructed through statistical learning methods to estimate adsorbed shale gas content

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