Machine Learning-Accelerated Multi-Objective Design of Fractured Geothermal Systems

Multi-objective optimization has burgeoned as a potent methodology for informed decision-making in enhanced geothermal systems, aiming to concurrently maximize economic yield, ensure enduring geothermal energy provision, and curtail carbon emissions. However, addressing a multitude of design parameters inherent in computationally intensive physics-driven simulations constitutes a formidable impediment for geothermal design optimization, as well as across a broad range of scientific and engineering domains. Here we report an Active Learning enhanced Evolutionary Multi-objective Optimization algorithm, integrated with hydrothermal simulations in fractured media, to enable efficient optimization of fractured geothermal systems using few model evaluations. We introduce probabilistic neural network as classifier to learns to predict the Pareto dominance relationship between candidate samples and reference samples, thereby facilitating the identification of promising but uncertain offspring solutions. We then use active learning strategy to conduct hypervolume based attention subspace search with surrogate model by iteratively infilling informative samples within local promising parameter subspace. We demonstrate its effectiveness by conducting extensive experimental tests of the integrated framework, including multi-objective benchmark functions, a fractured geothermal model and a large-scale enhanced geothermal system. Results demonstrate that the ALEMO approach achieves a remarkable reduction in required simulations, with a speed-up of 1-2 orders of magnitude (10-100 times faster) than traditional evolutionary methods, thereby enabling accelerated decision-making. Our method is poised to advance the state-of-the-art of renewable geothermal energy system and enable widespread application to accelerate the discovery of optimal designs for complex systems.

Optimization of geological carbon storage operations with multimodal latent dynamic model and deep reinforcement learning

Maximizing storage performance in geological carbon storage (GCS) is crucial for commercial deployment, but traditional optimization demands resource-intensive simulations, posing computational challenges. This study introduces the multimodal latent dynamic (MLD) model, a deep learning framework for fast flow prediction and well control optimization in GCS. The MLD model includes a representation module for compressed latent representations, a transition module for system state evolution, and a prediction module for flow responses. A novel training strategy combining regression loss and joint-embedding consistency loss enhances temporal consistency and multi-step prediction accuracy. Unlike existing models, the MLD supports diverse input modalities, allowing comprehensive data interactions. The MLD model, resembling a Markov decision process (MDP), can train deep reinforcement learning agents, specifically using the soft actor-critic (SAC) algorithm, to maximize net present value (NPV) through continuous interactions. The approach outperforms traditional methods, achieving the highest NPV while reducing computational resources by over 60%. It also demonstrates strong generalization performance, providing improved decisions for new scenarios based on knowledge from previous ones.

LLM4ED: Large Language Models for Automatic Equation Discovery

Equation discovery is aimed at directly extracting physical laws from data and has emerged as a pivotal research domain. Previous methods based on symbolic mathematics have achieved substantial advancements, but often require the design of implementation of complex algorithms. In this paper, we introduce a new framework that utilizes natural language-based prompts to guide large language models (LLMs) in automatically mining governing equations from data. Specifically, we first utilize the generation capability of LLMs to generate diverse equations in string form, and then evaluate the generated equations based on observations. In the optimization phase, we propose two alternately iterated strategies to optimize generated equations collaboratively. The first strategy is to take LLMs as a black-box optimizer and achieve equation self-improvement based on historical samples and their performance. The second strategy is to instruct LLMs to perform evolutionary operators for global search. Experiments are extensively conducted on both partial differential equations and ordinary differential equations. Results demonstrate that our framework can discover effective equations to reveal the underlying physical laws under various nonlinear dynamic systems. Further comparisons are made with state-of-the-art models, demonstrating good stability and usability. Our framework substantially lowers the barriers to learning and applying equation discovery techniques, demonstrating the application potential of LLMs in the field of knowledge discovery.

Rank-Based Learning and Local Model Based Evolutionary Algorithm for High-Dimensional Expensive Multi-Objective Problems

Surrogate-assisted evolutionary algorithms have been widely developed to solve complex and computationally expensive multi-objective optimization problems in recent years. However, when dealing with high-dimensional optimization problems, the performance of these surrogate-assisted multi-objective evolutionary algorithms deteriorate drastically. In this work, a novel Classifier-assisted rank-based learning and Local Model based multi-objective Evolutionary Algorithm (CLMEA) is proposed for high-dimensional expensive multi-objective optimization problems. The proposed algorithm consists of three parts: classifier-assisted rank-based learning, hypervolume-based non-dominated search, and local search in the relatively sparse objective space. Specifically, a probabilistic neural network is built as classifier to divide the offspring into a number of ranks. The offspring in different ranks uses rank-based learning strategy to generate more promising and informative candidates for real function evaluations. Then, radial basis function networks are built as surrogates to approximate the objective functions. After searching non-dominated solutions assisted by the surrogate model, the candidates with higher hypervolume improvement are selected for real evaluations. Subsequently, in order to maintain the diversity of solutions, the most uncertain sample point from the non-dominated solutions measured by the crowding distance is selected as the guided parent to further infill in the uncertain region of the front. The experimental results of benchmark problems and a real-world application on geothermal reservoir heat extraction optimization demonstrate that the proposed algorithm shows superior performance compared with the state-of-the-art surrogate-assisted multi-objective evolutionary algorithms. The source code for this work is available at https://github.com/JellyChen7/CLMEA.