A computational method for finding transition states in chemical reactions, greatly reducing computational costs with high reliability, has been devised. Compared to the most widely used existing ...

A computational method combining generative AI with atomistic simulations can identify promising platinum alloy catalyst structures for hydrogen fuel cells, report researchers from Science Tokyo.

A team of physicists has developed a groundbreaking method for detecting congestive heart failure with greater ease and precision than previously thought possible. This multidisciplinary study, ...