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.
The BIO-SANS instrument, located at Oak Ridge National Laboratory’s High Flux Isotope Reactor, is the latest neutron scattering instrument to be retrofitted with state-of-the-art robotics and custom software. The sophisticated upgrade quadruples the number of samples the instrument can measure automatically and significantly reduces the need for human assistance.
Plans to unite the capabilities of two cutting-edge technological facilities funded by the Department of Energy’s Office of Science promise to usher in a new era of dynamic structural biology. Through DOE’s Integrated Research Infrastructure, or IRI, initiative, the facilities will complement each other’s technologies in the pursuit of science despite being nearly 2,500 miles apart.
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.
ORNL’s Erin Webb is co-leading a new Circular Bioeconomy Systems Convergent Research Initiative focused on advancing production and use of renewable carbon from Tennessee to meet societal needs.
Shift Thermal, a member of Innovation Crossroads’ first cohort of fellows, is commercializing advanced ice thermal energy storage for HVAC, shifting the cooling process to be more sustainable, cost-effective and resilient. Shift Thermal wants to enable a lower-cost, more-efficient thermal energy storage method to provide long-duration resilient cooling when the electric grid is down.
Chelsea Chen, a polymer physicist at ORNL, is studying ion transport in solid electrolytes that could help electric vehicle battery charges last longer.
Ilenne Del Valle is merging her expertise in synthetic biology and environmental science to develop new technologies to help scientists better understand and engineer ecosystems for climate resilience.
New computational framework speeds discovery of fungal metabolites, key to plant health and used in drug therapies and for other uses.
Technology Transfer staff from Department of Energy’s Oak Ridge National Laboratory attended the 2024 Consumer Electronics Show, or CES, in Las Vegas, Jan. 8–12.