Material Datasets

Material datasets are collections of structured data representing the properties and characteristics of materials, aiming to accelerate materials discovery and design through machine learning. Current research focuses on developing large-scale, diverse datasets encompassing various material types and properties, often employing graph neural networks (GNNs) and other deep learning architectures for property prediction and material representation learning. These datasets, coupled with advanced algorithms, are crucial for improving the accuracy and efficiency of materials simulations and predictions, ultimately impacting fields like energy, manufacturing, and medicine.

Papers