Standardizing calculations of the helium byproducts generated in advanced fission and fusion energy system materials can increase reactor safety and longevity, according to a study led by University ...

Temperature adds another challenge. Standard DFT is essentially a zero-temperature approach, so thermal effects must be ...

How can artificial intelligence improve the analysis of chromatographic data? Artificial intelligence (AI) is a powerful and ...

The transition toward sustainable and low-carbon energy systems is driving the rapid development of emerging infrastructures based, for example, on ...

Ligand-based drug design combines AI and QSAR modeling to prioritize drug candidates, minimizing preclinical failures and ...