A suite of new modeling methods gives researchers better tools to predict molecular behavior inside cavities.

Margaret Cheung elected to premier scientific society

A recent article highlighted a PNNL report focused on post-quantum cryptography and electric vehicle charging infrastructure.

The Hanford Site is now immobilizing radioactive waste in glass: a process known as vitrification. PNNL contributed 60 years of materials science expertise—and is providing operational support—to help the nation meet this cleanup milestone.

Localized gradients in magnetic fields have long-range effects on the concentration of rare earth ions in solution, facilitating field-driven extraction of critical minerals.

Mystery of how important aluminum minerals form and dissolve solved with materials science and advanced imaging studies.

Nanosize platelets of an aluminum material slide and join in a staggered orientation to form larger crystals.

Yong Wang will lead the Institute for Integrated Catalysis, advancing the science and technology of catalysis to address global challenges in energy resilience.

Early career researchers recognized with Team Science Award by the Department of Energy for presentation highlighting the collaborative science performed by IDREAM.

The Department of Energy, Basic Energy Sciences and Advanced Scientific Computing Research programs will support the partnership’s work on nuclear quantum behavior.

An approach combining multiple theories increases the accuracy of quantum-based simulations without increasing computational demands.

IDREAM researchers uncovered how dimeric complexes control how aluminum hydroxide minerals dissolve.

Hydrogen preferentially inserts at grain boundaries between interconnected chains of palladium nanoparticles, which have a lower energy barrier for hydrogen incorporation into the material.

Scientists provide a guide for the rational application of continuum descriptions of fluid flows based on interfacial chemistry.

Ice crystals are surprisingly tolerant of defects in their structure. The findings come from the first-ever molecular-resolution observations of nanoscale samples of ice frozen from liquid water.

A new peptoid force field better predicts the cis/trans equilibrium of peptoids in multiple solvents.

Nanoscale domains of magnetically susceptible critical materials encounter enhanced magnetic interactions under external magnetic fields, providing a promising new avenue for separations.

A new approach combining computational processes enables the more accurate simulation of nuclear quantum effects in molecular systems.

Micron and PNNL co-design the Crete computer system, delivering a new memory architecture for data-intensive scientific computing and AI applications.

Delivering an integrated quantum-mechanical and experimental perspective on the effects of both intrinsic and externally applied electric fields at atomic-scale interfaces.