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ORNL scientists used molecular dynamics simulations, exascale computing, lab testing and analysis to accelerate the development of an energy-saving method to produce nanocellulosic fibers.

A team led by scientists at ORNL identified and demonstrated a method to process a plant-based material called nanocellulose that reduced energy needs by a whopping 21%, using simulations on the lab’s supercomputers and follow-on analysis.

Wavy photo representing high performance computing

Office of Science to announce a new research and development opportunity led by ORNL to advance technologies and drive new capabilities for future supercomputers. This industry research program worth $23 million, called New Frontiers, will initiate partnerships with multiple companies to accelerate the R&D of critical technologies with renewed emphasis on energy efficiency for the next generation of post-exascale computing in the 2029 and beyond time frame.

The Frontier supercomputer simulated magnetic responses inside calcium-48, depicted by red and blue spheres. Insights into the nucleus’s fundamental forces could shed light on supernova dynamics.

Nuclear physicists at the Department of Energy’s Oak Ridge National Laboratory recently used Frontier, the world’s most powerful supercomputer, to calculate the magnetic properties of calcium-48’s atomic nucleus. 

ORNL researchers Tom Beck, left, Sarp Oral and Rafael Ferreira da Silva have proposed a strategy for integrating classical supercomputers such as Frontier, the world’s first exascale computer, with the emerging field of quantum computing.

A study by more than a dozen scientists at the Department of Energy’s Oak Ridge National Laboratory examines potential strategies to integrate quantum computing with the world’s most powerful supercomputing systems in the pursuit of science.

Angelique Adams, front left, introduces Kusum Rathore, front center, executive director and vice president of the multi-campus office at the University of Tennessee Research Foundation, and Jim Biggs, executive director of the Knoxville Entrepreneur Center, during the final presentation event for ORNL’s Safari coaching program.

Five researchers at the Department of Energy’s Oak Ridge National Laboratory recently completed an eight-week pilot commercialization coaching program as part of Safari, a program funded by DOE’s Office of Technology Transitions, or OTT, Practices to Accelerate the Commercialization of Technologies, or PACT. 

Image with a grey and black backdrop - in front is a diamond with two circles coming out from it, showing the insides.

The world’s fastest supercomputer helped researchers simulate synthesizing a material harder and tougher than a diamond — or any other substance on Earth. The study used Frontier to predict the likeliest strategy to synthesize such a material, thought to exist so far only within the interiors of giant exoplanets, or planets beyond our solar system.

This is an image of a man sitting at a computer with three screens.

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.

Man in blue shirt and grey pants holds laptop and poses next to a green plant in a lab.

John Lagergren, a staff scientist in Oak Ridge National Laboratory’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 Oak Ridge National Laboratory researchers used Frontier to explore training strategies for one of the largest artificial intelligence models to date. Credit: Getty Images

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.
 

Frontier supercomputer sets new standard in molecular simulation

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.