LEMONT, Ill, July 8, 2026 — Computers have made it easier than ever before to design the perfect material for a given problem: Scientists can create a virtual version and simulate how that material will behave. Building these atomically precise simulations, however, typically requires deep expertise in computational chemistry. At the U.S. Department of Energy’s (DOE) […] The post Argonne Team’s ChemGraph Unlocks AI for Chemistry and Materials Science appeared first on HPCwire .
Source: HPCwire — read the full report at the original publisher.