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Caption: Participants gather for a group photo after discussing securing AI systems for critical national security data and applications.  Photo by Liz Neunsinger/ORNL, U.S. Dept. of Energy

Researchers at the Department of Energy’s Oak Ridge National Laboratory met recently at an AI Summit to better understand threats surrounding artificial intelligence. The event was part of ORNL’s mission to shape the future of safe and secure AI systems charged with our nation’s most precious data. 

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.

ORNL researchers have teamed up with other national labs to develop a free platform called Open Energy Data Initiative Solar Systems Integration Data and Modeling to better analyze the behavior of electric grids incorporating many solar projects. Credit: Andy Sproles/ORNL, U.S. Dept. of Energy

ORNL researchers have teamed up with other national labs to develop a free platform called Open Energy Data Initiative Solar Systems Integration Data and Modeling to better analyze the behavior of electric grids incorporating many solar projects. 

Joon-Seok Kim Credit: Genevieve Martin/ORNL, U.S. Dept. of Energy

Researchers at ORNL are using a machine-learning model to answer ‘what if’ questions stemming from major events that impact large numbers of people. By simulating an event, such as extreme weather, researchers can see how people might respond to adverse situations, and those outcomes can be used to improve emergency planning.

Quietly making noise: Measuring differential privacy could balance meaningful analytics and identity protection

To balance personal safety and research innovation, researchers at ORNL are employing a mathematical technique known as differential privacy to provide data privacy guarantees.

Study reveals flaw in long-accepted approximation used in water simulations

Computational scientists at ORNL have published a study that questions a long-accepted factor in simulating the molecular dynamics of water: the 2 femtosecond time step. According to the team’s findings, using anything greater than a 0.5 femtosecond time step can introduce errors in both the dynamics and thermodynamics when simulating water using a rigid-body description.

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Simulations performed on the Summit supercomputer at ORNL are cutting through that time and expense by helping researchers digitally customize the ideal alloy. 

ORNL researchers modeled how hurricane cloud cover would affect solar energy generation as a storm followed 10 possible trajectories over the Caribbean and Southern U.S. Credit: Andy Sproles/ ORNL,U.S. Dept. of Energy

ORNL researchers modeled how hurricane cloud cover would affect solar energy generation as a storm followed 10 possible trajectories over the Caribbean and Southern U.S.

Researchers relied on support from ORNL’s Quantum Computing User Program to simulate a key quantum state at one of the largest scales reported. The findings could mark a step toward improving quantum simulations.  Credit: Getty Images

Researchers simulated a key quantum state at one of the largest scales reported, with support from the Quantum Computing User Program, or QCUP, at ORNL. 

Credit: Tyler Spano/ORNL, U.S. Dept. of Energy

Nuclear nonproliferation scientists at ORNL have published the Compendium of Uranium Raman and Infrared Experimental Spectra, a public database and analysis of structure-spectral relationships for uranium minerals. This first-of-its-kind dataset and corresponding analysis fill a key gap in the existing body of knowledge for mineralogists and actinide scientists.