Computational chemistry libraries from NWChem, NWChemEX, SPEC, and more are now available on Azure Quantum Elements.

Katalenich was selected to attend the Grainger Foundation Frontiers of Engineering 2023 Symposium—an honor given to only 100 early-career engineers annually.

A team of researchers at PNNL designed and constructed an atmospheric chamber to simulate the fate of volatile and semivolatile radioisotopes.

PNNL researchers outline open problems in different scientific areas in the Journal of Combinatorics.

Research from PNNL and the University of Washington demonstrates the extension of the MBE for periodic systems and its use to decompose the lattice energies of different ice polymorphs.

To overcome high-performance computing bottlenecks, a research team at PNNL proposed using graph theory, a mathematical field that explores relationships and connections between a number, or cluster, of points in a space.

Researchers have knitted together three large databases of information to help cybersecurity experts detect and prevent attacks.

Brian Milbrath, a physicist at Pacific Northwest National Laboratory (PNNL), was selected as a new Task Leader for the PrepCom’s Working Group B.

Physicist Emily Mace will share her science journey and an interactive presentation about her current research with middle school and high school students from across the country at the National Science Bowl.

Research.com ranked PNNL joint appointee George Karniadakis as one of the top mathematicians in the world.

Advances in understanding the nature of the chemical bond are featured in this special issue of The Journal of Chemical Physics.

Deep learning helps make predictions on the effects of the El Niño-Southern Oscillation on river flows more accurate.

PNNL welcomes new joint appointments to expand the research productivity and scientific impact of both PNNL and the university partners, broadening the base of expertise at each institution and helping to build interdisciplinary teams.

Artificial intelligence may help humans and computers work together to monitor materials that could be used to make weapons.

PNNL researchers combined deep operator networks with spectral methods to efficiently and accurately solve complex equations.

The Building and Environment journal named Drgoňa’s co-authored work one of 2022’s best papers.

Exploring why some brains are more resilient to the impact of Alzheimer’s disease could lead to improved diagnoses, treatment and prevention.

Scientists have taken a key step toward harnessing a form of AI known as deep reinforcement learning to protect computer networks.

Samantha Erwin was one of six speakers during the Careers Using Mathematics panel at the Nebraska Conference for Undergraduate Women in Mathematics.

The work by the team at PNNL takes a critical step in leveraging ML to accelerate advanced manufacturing R&D, specifically for manufacturing techniques without access to efficient, first-principles simulations.