November 21, 2024
Machine learning has become a buzzword in all areas of science, and the hype around it can make it difficult to differentiate fact from (science) fiction. When it comes to researching new materials, some scientists believe we are now at the beginning of a second computational revolution at the hands of machine learning. But is that really true?
Materials science already went through a revolution in the 20th century with the advent of computational methods such as density functional theory (DFT), Monte Carlo simulations, and molecular dynamics.