More than 4,000 naturally occurring minerals—inorganic solids that have a characteristic chemical composition and specific crystal structure ... or individual elements arranged in repeating ...

Polymorphs are not mythical, chimeric beasts—they are substances with identical chemical compositions but differing crystal ...

As the clouds clear on computational crystal structure prediction, is the technique ready to empower mainstream materials ...

A research team from the Institute of Statistical Mathematics and Panasonic Holdings Corporation has developed a machine ...

Development of ShotgunCSP: a crystal structure prediction algorithm combining machine learning and first-principles calculations.Achieved world-leading performance in crystal structure prediction ...