Artificial intelligence helps analyze images and reduce uncertainty for a key measure of watershed function.

Dynamic organic matter traits tied to reactions can surpass static descriptors in explaining decomposition rates and responses to environmental change.

Using an AI approach to combine outputs from microbial models and apply them as inputs to reactive-transport models reduces computational time by several orders of magnitude.

Establishing how electronic redistribution, protonation, and solvent rearrangement are coupled during a proton-coupled electron transfer process.

New software enables the study of nuclear quantum effects in large, condensed phase systems up to 10× faster than traditional methods.

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

PNNL has developed a next-generation electrical resistivity tomography system for DOE that uses E4D software and AI-enhanced modeling to produce real-time subsurface images that help guide environmental remediation decisions.

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

RemPlex 2025 Global Summit on Environmental Remediation attendees share knowledge about cleanup and monitoring of complex sites worldwide; more than 100 presentations are posted online.

Darío Gil, DOE's Undersecretary for Science, makes his inaugural visit to PNNL.

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

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

The first direct molecular-scale evidence of the temperature-driven transformation of the coordination environment of ytterbium at geologically relevant conditions.

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

Isotopically layered water films and slow heating enable diffusion tracking.

A team combined experiments and theory to predict the collective properties of electrolyte solutions.

The first measurement of the proton diffusion constant at cryogenic temperatures provides insights into the mechanism of proton movement in supercooled water.

Neural networks techniques enable the efficient capture of electron correlation effects in reduced-dimensionality spaces.

In the search for rare physics events, extremely pure materials are essential. A partnership between PNNL and Ultramet has led to tungsten with low contamination from other elements.

Developing a new scheme to more efficiently solve quantum chemistry problems.