A new way to see stress—using supercomputers

It's easy to take a lot for granted. Scientists do this when they study stress, the force per unit area on an object. Scientists handle stress mathematically by assuming it to have symmetry. That means the components of stress ...

Fullerene compounds made simulation-ready

What in the smart nanomaterials world is widely available, highly symmetrical and inexpensive? Hollow carbon structures, shaped like a football, called fullerenes. Their applications range from artificial photosynthesis and ...

Researchers study interactions in molecules using AI

Researchers from the University of Luxembourg, Technische Universität Berlin, and the Fritz Haber Institute of the Max Planck Society have combined machine learning and quantum mechanics to predict the dynamics and atomic ...

Simulations reveal role of calcium in titanium implant acceptance

Titanium-based materials are widely used in medical implant technology. Coating the surface of titanium materials with biologically active molecules has recently shown promise to improve how cells adhere to implants and promote ...

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