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.
Groundbreaking report provides ambitious framework for accelerating clean energy deployment while minimizing risks and costs in the face of climate change.
Scientists at Oak Ridge National Laboratory and six other Department of Energy national laboratories have developed a United States-based perspective for achieving net-zero carbon emissions.
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.
Thomas Proffen, a neutron scattering scientist at ORNL and founder of Oak Ridge Computer Science Girls, was recognized with an award from the National Center for Women & Information Technology, or NCWIT. In addition, one of his students received a national honor from the organization.
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.
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.
Forrest Hoffman, a distinguished scientist at the Department of Energy’s Oak Ridge National Laboratory, has been named a senior member of the Institute of Electrical and Electronics Engineers, the world’s largest organization for technical professionals.
The Neutron Scattering Society of America, or NSSA, recognized Oak Ridge National Laboratory’s Ke An and Ken Herwig as fellows for their outstanding contributions to neutron scattering.