A combined experimental and computational approach showed that the hydration shell of hydroxide has a four-coordinate binding.

New research makes molecular-level calculations of water faster and easier.

New research shows that compressing quantum circuits decreases noise and increases the accuracy of quantum calculations.

Tiffany Kaspar’s work has advanced the discovery and understanding of oxide materials, helping develop electronics, quantum computing, and energy production. She strives to communicate her science to the public.

PNNL researchers developed a hybrid quantum-classical approach for coupled-cluster Green’s function theory that maintains accuracy while cutting computational costs.

The Co-Optimization of Fuels & Engines initiative recently outlined six years of research in a findings and impact report.

Xantheas awarded a visiting fellowship from the International Center for Advanced Studies of Energy Conversion in Germany.

Structural changes in heavy water occur at different temperatures than in standard water.

The size of the alkali metal within the material influences the crystallization pathway.

PNNL researchers utilized the Peeters-Devreese-Soldatov formulation to improve the accuracy of calculations for quantum chemistry.

PNNL catalysis expert Yong Wang has assumed an associate editor role for the Chemical Engineering Journal.

A comprehensive understanding of the electronic structure of uranyl ions provides insight into the chemistry of nuclear waste and uranium separation technologies.

A multi-institution team of researchers has developed a palladium-based catalyst that could clean emissions from natural gas engines.

Researchers achieved the complete assignment of the infrared spectrum of a hydronium-water “magic number” cluster reported in Science in 2004.

PNNL is rock solid on carbon storage, building on successful demonstration in eastern Washington.

Scott Chambers creates layered structures of thin metal oxide films and studies their properties, creating materials not found in nature. He will soon move his instrumentation and research to the new Energy Sciences Center.

PNNL physicist Bruce Kay, global leader in supercooled water research, prepares for move to Energy Sciences Center.

A discovery from PNNL and Washington State University could help reduce the amount of expensive material needed to treat vehicle exhaust by making the most of every precious atom.

A new report led by PNNL identifies the top 13 most promising waste- and biomass-derived diesel blendstocks for reducing greenhouse gas emissions, other pollutants, and overall system costs.

New study elucidates the complex relaxation kinetics of supercooled water using a pulsed laser heating technique at previously inaccessible temperatures.