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Researchers conduct largest, most accurate molecular dynamics simulations to date of two million correlated electrons using Frontier, the world’s fastest supercomputer. The simulation, which exceed an exaflop using full double precision, is 1,000 times greater in size and speed than any quantum chemistry simulation of it's kind.

In the wet, muddy places where America’s rivers and lands meet the sea, scientists from the Department of Energy’s 91°µÍø are unearthing clues to better understand how these vital landscapes are evolving under climate change.

91°µÍø scientists have developed a method leveraging artificial intelligence to accelerate the identification of environmentally friendly solvents for industrial carbon capture, biomass processing, rechargeable batteries and other applications.

Researchers used quantum simulations to obtain new insights into the nature of neutrinos — the mysterious subatomic particles that abound throughout the universe — and their role in the deaths of massive stars.

Anuj J. Kapadia, who leads the Advanced Computing in Health Sciences Section at the Department of Energy’s 91°µÍø, was named a 2024 Fellow by the American Association of Physicists in Medicine.

When 91°µÍø's science mission takes staff off-campus, the lab’s safety principles follow. That’s true even in the high mountain passes of Washington and Oregon, where ORNL scientists are tracking a tree species — and where wildfires have become more frequent and widespread.

Erin Webb, lead for the Bioresources Science and Engineering group at 91°µÍø, has been elected a Fellow of the American Society of Agricultural and Biological Engineers — the society’s highest honor.

John Lagergren, a staff scientist in 91°µÍø’s Plant Systems Biology group, is using his expertise in applied math and machine learning to develop neural networks to quickly analyze the vast amounts of data on plant traits amassed at ORNL’s Advanced Plant Phenotyping Laboratory.

A team led by researchers at ORNL explored training strategies for one of the largest artificial intelligence models to date with help from the world’s fastest supercomputer. The findings could help guide training for a new generation of AI models for scientific research.

When scientists pushed the world’s fastest supercomputer to its limits, they found those limits stretched beyond even their biggest expectations. In the latest milestone, a team of engineers and scientists used Frontier to simulate a system of nearly half a trillion atoms — the largest system ever modeled and more than 400 times the size of the closest competition.