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

PNNL researchers created a model that helps materials scientists not only predict what is, but what could be.

PNNL researchers design an artificial intelligence-guided electron microscope in a Laboratory Directed Research and Development study.

Tuning the environment and platinum-group metal allows researchers to control which bonds the catalyst breaks using hydrogen.

Researchers are studying the chemical reactions that occur when oxygen mixes into the surface of oxide materials.

Combining multiple experimental techniques allowed researchers to observe the early stages of oxidation in a model material.

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

PNNL scientists developed new capabilities to study materials under extreme conditions.

Combining advanced powder synthesis with solid state processing allows researchers to streamline oxide dispersion-strengthened steel fabrication.

Ionic liquids bound to thin layers of graphene oxide produces more selective and efficient multi-layer membranes for water filtration.

Under high temperature conditions, hematite nanocrystals change shape to expose the (001) facet and attach to form one-dimensional chains regardless of their initial structure.

Researchers in the IDREAM Energy Frontier Research Center unearth new defects during gibbsite crystallization using a multi-instrument approach.

Quantum simulators help navigate noise on GPU-based HPC systems.

Different sized helium cavities that form after ion irradiation are unevenly distributed in a ductile-phase toughened tungsten composite.

Surface characterization allows researchers to explore the compatibility between different solvent-membrane combinations.

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

Using size-tunable ionic liquid clusters make electrochemical separations more efficient.

Newly determined energy transfer mechanisms help identify how water releases from and damages irradiated interfaces.

Developing an understanding of how water breaks apart after radiation exposure.

IDREAM researchers use fast force mapping to provide insights into the boehmite interfacial solution structure.