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.

Scott Whalen, a chief scientist in the Applied Materials and Manufacturing group at PNNL, has been named 2023 PNNL Inventor of the Year

With her broad experience and background, Starr Abdelhadi was selected from many applicants to join the Women in IT Networking at SC (WINS) program for Super Computing 2024 (SC24).

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

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

New research informs the development of foundational models for computational chemistry through hardware-software co-design.

Americans produce enough waste every year to replace up to a quarter of the country’s jet fuel with sustainable alternatives, new research shows.

PNNL electrical engineer Samrat Acharya led a team that earned the 2024 IEEE Innovative Smart Grid Technologies Conference Best Paper Award.

As new paradigms in advanced computing take shape, computational chemistry researchers are finding new ways to solve challenging chemistry problems.

The next-generation ShAPE machine has arrived at PNNL, where it will help prove the mettle of the ShAPE extrusion technique. ShAPE 2 is designed to allow researchers to produce larger, more complex extrusions.

The SHASTA program is doing a deep dive on subsurface hydrogen storage in underground caverns, helping to lay the foundation for a robust hydrogen economy.

Students participating in the Public Infrastructure Security Cyber Education System program at the University of Montana recently discovered and appropriately escalated an anomaly that turned out to be a concern.

Researchers investigated how stable nanoparticle suspensions form using facet engineering on hematite nanoparticles, demonstrating that controlling the faceting of nanoparticles can effectively maintain particle dispersity.

Researchers at PNNL have developed a new technique to get a high-resolution look at how—and why—corrosion happens.

In 2006, battery research was practically non-existent at PNNL. Today, the lab is lauded for its battery research. How did PNNL go from a new player to a leader in state-of-the-art storage for EVs and the grid?

Chemists Wilma Rishko and Samantha Johnson are set to receive an ACS Division of Inorganic Chemistry Award for Undergraduate Research as a mentor-mentee pair.

Researchers devised a quantitative and predictive understanding of the cloud chemistry of biomass-burning organic gases helping increase the understanding of wildfires.

Adom Cooper was selected for the inaugural cohort of the Black Professionals in International Affairs at the Colin Powell Leadership Institute.

Models have identified a new source of anthropogenic emissions driving the observed weakening of the Atlantic Meridional Overturning Circulation.

Reproducible workflows for binning and visualizing nuclear magnetic resonance spectra from environmental samples.