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

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

Adam Attarian led a new panel session, titled National Labs and the GEOINT Mission, at the GEOINT 2023 Symposium, held May 21–24, 2023.

ExaGO, a power grid simulation and optimization platform developed at PNNL is the first of its kind to run on Frontier.

PNNL and The University of Texas at El Paso expand their premier partnership to include the Cyber Halo Innovation Research Program.

By mimicking nature, scientists make a breakthrough in breaking down wood.

The popular approach of organizing soil bacteria into fast- or slow-growing groups is problematic because most bacteria grow at comparable rates in soil.

Metabolomics analysis revealed differences in metabolome profiles for two distinct modes of fungal wood decay.

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.

The ChemSpace Tool, when fully developed, is intended to divide chemical space into three subsets: the detectable space, the identifiable space, and the region that includes compounds that are not detectable or identifiable.

Methods review suggests ways to use artificial intelligence and machine learning to handle missing data when integrating two or more omics approaches.

COVID-19 infections at PNNL early in the pandemic were caused by a wide variety of viral sequences, according to a new analysis by Laboratory researchers.

Three PNNL authored papers were accepted as posters to the ICLR 2023 Workshop on Physics for Machine Learning and Workshop on Mathematical and Empirical Understanding of Foundation Models.

A project team at PNNL has been honored with the Project Management Achievement Award for 2022 from the Department of Energy.

Under Secretary for Science and Innovation at the Department of Energy Geri Richmond visited PNNL.

SAGE is a high-efficiency genome integration strategy for bacteria that makes the stable introduction of new traits simple for newly discovered microbes.

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.