Electron density prediction for a four-million-atom aluminum system using machine learning, deemed to be infeasible using traditional DFT method. × Researchers from Michigan Tech and the University of ...

Machine learning, a branch of artificial intelligence, allows a computer to teach itself how to solve problems by analyzing large sets of data.

Conventional clustering techniques often focus on basic features like crystal structure and elemental composition, neglecting target properties such as band gaps and dielectric constants. A new study ...

On October 3-4, 2025,The Federal Reserve Bank of Philadelphia and the Center for Applied AI at the University of Chicago Booth School of Business are co-hosting a conference on Frontiers in Machine ...

The field of computational materials science has been profoundly transformed by integrating deep learning and other machine learning methodologies. These sophisticated data-driven approaches have ...