PNNL staff scientist selected as a guest editor for a special issue titled “Ligand-Metal Complementarity in Rare Earth and Actinide Chemistry,” in the well-known journal Inorganic Chemistry.

A new study examines the effect of peptoid sequences on the mechanisms and kinetics of their two-dimensional assembly on mica surfaces and how molecular interactions alter assembly kinetics.

A team of researchers from Pacific Northwest National Laboratory and the Environmental Molecular Sciences Laboratory developed a new and flexible software tool called “Advanced Spectra PCA Toolbox.”

The Lab’s newly formed Center for AI, in partnership with NVIDIA, recently hosted a joint “LLM Day.” During the day, NVIDIA AI experts engaged with PNNL scientists on opportunities to make generative AI a powerful tool for science.

A new study demonstrates a hybrid model that can simulate part of a system at the molecular scale and other parts at larger scales in a computationally efficient manner, providing greater simulation flexibility.

PNNL played host in mid-May to the Artificial Intelligence for Robust Engineering & Science workshop, an annual event that explores advances in artificial intelligence

PNNL shared recent developments in artificial intelligence at the inaugural Special Competitive Studies Project AI for National Competitiveness Expo.

A PNNL Deep Vadose Zone Program publication that shows ferrihydrite helps protect groundwater is featured on the cover of ACS Earth and Space Chemistry.

New research investigating water-lean solvents for carbon dioxide capture identifies the unique chemistry possible with their use, may lead to new design principles that move beyond single carbon capture.

Publisher will draw on Katrina Waters' expertise in public health and infectious disease.

Long-range electron transfer reactions play important roles in many chemical and biochemical processes. A new study demonstrates that a common organic host molecule can behave like an alkali metal in long-range electron transfer reactions.

PNNL’s Nell Byler and Elise Bishoff shared their computer vision expertise with high school students at the National Science Bowl Science Day

Scientists at PNNL harnessing advances in deep learning, deep reinforcement learning and generative AI to change how science is conducted and achieve original scientific results and breakthroughs.

Scientists unravel a secret to oil production in plants, opening up the possibility of increasing production for biofuels and other applications.

The 2024 Jack Simons Award honor recognizes Li for his expertise in integrating chemistry with computing for fundamental science research.

Research at PNNL and the University of Texas at El Paso are addressing computational challenges of thinking beyond the list and developing bioagent-agnostic signatures to assess threats.

PNNL’s Andrew Engel, Tony Chiang, and Sutanay Choudhury at the 2024 ICLR in Vienna.

PNNL researchers learn to control peptoid “handedness,” one key to precision drug delivery and diagnostics.

New research sheds light on the biomolecular dangers of night shift work.

PNNL contributes to a nationwide research consortium investigating the molecular mechanisms triggered by endurance training.