Exploring Multi-Fidelity Data in Materials Science: Challenges, Applications, and Optimized Learning Strategies

Abstract

Machine learning techniques offer tremendous potential for optimizing resource allocation in solving real-world problems. However, the emergence of multi-fidelity data introduces new challenges. This paper offers an overview of the definition, applications, data preprocessing methodologies, and learning approaches associated with multi-fidelity data. To validate the algorithms, we examine three widely-used learning methods relevant to multi-fidelity data through the design of multi-fidelity datasets that encompass various types of noise. As we expected, employing multi-fidelity data learning methods yields better results compared to solely using high-fidelity data learning methods. Additionally, considering the inherent various types of noise within datasets, the comprehensive correction strategy proves to be the most effective. Moreover, multi-fidelity learning methods facilitate effective decision-making processes by enabling the combination of datasets from various sources. They extract knowledge from lower fidelity data, improving model accuracy compared to models solely relying on high-fidelity data.

Keywords

• multi-fidelity data
• data noise
• machine learning
• property prediction