A new time-dependent wavefunction formulation for the cumulant Green’s functions can produce more accurate simulations.

PNNL researchers received an award from the Materials, Metals & Materials Society (TMS) for a publication on friction riveting.

Scientists are reviewing the current science of the mechanism and structural dynamics of methyl coenzyme-M reductase, an enzyme involved in biological methane conversion.

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

Researchers developed a pathway for the solution synthesis of core–crown heterostructures with controlled electronic properties.

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

Under an optical field, nanoparticle attachment in a model system heavily depends on surface roughness.

Directionally biased electrostatic interactions are the key to significantly tuning the reduction potential of iron/sulfur clusters.

Researchers at PNNL studied the effects of high temperatures and ionizing radiation on tungsten heavy alloys.

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

Ampcera has an exclusive licensing agreement with PNNL to commercially develop and license a new battery material for applications such as vehicles and personal electronics.

The correlation between weld flash emissions and melt pool composition can provide near real-time feedback on weld quality.

A PNNL team has developed an energy- and chemical-efficient method of separating valuable critical minerals from dissolved solutions of rare earth element magnets.

Increasing concentrations of ions slows the rate of particle aggregation in boehmite suspensions.

Jingshan Du, a postdoctoral scientist at PNNL whose research focuses on crystallization pathways of water and other materials, was named a 2025 CAS Future Leader.

The structure and exposed surfaces of hematite particles affect their growth and dissolution.

Chemist Wendy Shaw, a nationally recognized scientific leader, has been chosen to serve as the associate laboratory director for PNNL's Physical and Computational Sciences Directorate.

Researchers have created an algorithm that slashes the calculations necessary to prepare and customize data for quantum computing.

Researchers discovered a new way to more efficiently and affordably create nickel-rich battery materials.

Machine learning and autonomous experimentation are poised to revolutionize how scientists grow very thin films on surfaces, important for technologies like microelectronics and quantum computing.