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Physical Sciences Division

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Featured Stories

Illustration showing an assembled nanostructure and chemical reactions
OCTOBER 14, 2026
Research Highlight

Peptoid Nanomaterials Promote Carbon Dioxide Dissolution and Precipitation

Tailored peptoid-based assemblies mimic metal-free enzymes with significantly higher stability.
( Read More )
Composite image of Ying Zhang (left) and Elisa Biasin (right)
OCTOBER 9, 2026
Article

Two PNNL Researchers Win DOE Early Career Research Awards

From studying the multisector ripple effects of extreme events to exploring the chemical reactions that underlie life on Earth, two up-and-coming PNNL scientists were recognized for their scientific vision and prowess.
( Read More )
Illustration of films forming
OCTOBER 2, 2026
Research Highlight

From Ion Ordering to Microphase Separation: How Charge Frustration Organizes Ions at Surfaces

Researchers discovered that frustrated electric forces drive a novel precipitation pathway called microphase separation and identified a precursor intermediate state of ordered ion networks.
( Read More )
Illustration of surface structure and reactivity
SEPTEMBER 29, 2026
Research Highlight

Surface Structure Controls Water Inhibition on Titanium Dioxide

Titanium dioxide surface structure exhibits water inhibition by forming distinct water–alkanol complexes.
( Read More )
Illustration of the COMPOSER framework
SEPTEMBER 23, 2026
Research Highlight

An Architecture to Reuse One Circuit Across Related Molecular Models

Separating quantum circuit wiring from molecular data allows researchers to more efficiently perform quantum simulations
( Read More )
Image showing molecular structures and a graph
SEPTEMBER 23, 2026
Research Highlight

Toward Predictive Speciation in Complex Electrolyte Solutions

Scientists uncovered the molecular basis of nitric acid speciation across dilute and concentrated solutions and identified competing hydration-shell rearrangements around lanthanide ions at the dilute limit.
( Read More )
Yong Wang
SEPTEMBER 11, 2026
Article

A First Appointment with Lasting Impact

Yong Wang’s joint appointment connects PNNL, WSU, and the next generation of scientists.
( Read More )
Illustration showing an artistic representation of electrocatalysis
SEPTEMBER 8, 2026
Research Highlight

Cathodic Polarization Enhances Catalytic Hydrogenation Rates Beyond the Charge Transfer Contribution

Demonstrated that cathodic potential accelerates aqueous phase benzaldehyde hydrogenation.
( Read More )
An illustration that shows an orange beam of light from the upper right, and a green beam of light signifying an X-ray coming from the lower right, coming together in a droplet within a jet of water; the water droplet then is magnified on the left to show graphic elements signifying electron transfer and proton transfer.
AUGUST 28, 2026
News Release

Scientists Capture First Molecular-Level Images of Water Reorganization During a Reaction Crucial for Life

New X-ray approach reveals how charge and surrounding water reorganize during a fundamental chemical reaction.
( Read More )
Simulated image of amine-functionalized membrane
AUGUST 27, 2026
Research Highlight

Amine Functionalization of Graphene Oxide Governs Membrane Stability and Adsorption Capacity in Rare Earth Element Separations

Amine functionalized graphene oxide yields laminates with an enhanced capacity to adsorb rare earth elements, improved water transport, and greater stability for effective membrane-based separation of critical minerals.
( Read More )
Image showing PCET reaction and synchrotron measurement equipment
AUGUST 27, 2026
Research Highlight

Revealing How Electronic Structure and Solvent Reorganize During Proton-Coupled Electron Transfer

Establishing how electronic redistribution, protonation, and solvent rearrangement are coupled during a proton-coupled electron transfer process.
( Read More )
This illustrates how research inside the DNP-NMR leads to molecular discoveries about gibbsite..
AUGUST 26, 2026
Article

Understanding How Trace Impurities in Nuclear Waste Change the Hydrogen Yield of Irradiated Gibbsite

Using multiple specialized techniques, IDREAM researchers gained a better understanding of how trace impurities within gibbsite affect the hydrogen yield.
( Read More )
image of different molecular simulation results
AUGUST 21, 2026
Research Highlight

How Enzymes Choose Left- or Right-Handed Products

By selectively stabilizing either a right- or left-handed helical pose of its substrate, an enzyme tunes the final product.
( Read More )
Illustration of a unicorn and wizard with molecules
AUGUST 18, 2026
Research Highlight

Electron Accessibility Controls Actinide Bonding

The availability of non-f electrons drives the reaction energies of actinide hydrides.
( Read More )
Figure showing the structure of a catalytic intermediate molecule
AUGUST 18, 2026
Research Highlight

Characterizing a Key, Elusive Copper Hydride Intermediate

Research provided definitive spectroscopic characterization, reactivity, and deactivation of a reactive monomeric diphosphine-copper hydride intermediate.
( Read More )
illustration of a material surface with highlighted defect states
AUGUST 3, 2026
Research Highlight

A New Window into 2D Materials: In Situ Control of Density of States and Reactivity

An innovative new approach enables direct measurements of electronic effects at solid–liquid interfaces.
( Read More )
Several people posing on a staircase.
JULY 22, 2026
News Release

Genesis Mission Awards to Accelerate AI Integration Across PNNL Science Mission

Genesis Mission awards to PNNL will advance scientific discovery, next-generation energy systems and advanced manufacturing, among others.
( Read More )
Image of molecular simulations
JUNE 30, 2026
Research Highlight

MixPI: A Path-Integral Software for Large Systems

New software enables the study of nuclear quantum effects in large, condensed phase systems up to 10× faster than traditional methods.
( Read More )
Figure showing different cluster structures
JUNE 30, 2026
Research Highlight

How Proteins Fine-Tune Nature’s Iron-Sulfur Electron Relays

Protein and water environments set the overall redox scale of iron-sulfur clusters, but local coordination geometry fine-tunes the final potential.
( Read More )
image showing different molecular structures
JUNE 30, 2026
Research Highlight

Controllable Distribution of Metal Cations in Zeolites

Developed a method for selectively anchoring diverse divalent metal cations in zeolites, important for precise control over catalytic materials.
( Read More )
A figure of an energy surface with clocks pointing to various points
JUNE 30, 2026
Research Highlight

Moving Toward More Effective Quantum Simulations of Molecular Dynamics

New theoretical framings of quantum dynamics enable better quantum-based simulation of molecular systems and dynamics.
( Read More )
Schematic showing carbenium formation and catalysis
JUNE 25, 2026
Research Highlight

Carbenium Ion Dynamics in Lewis Acid Catalyzed Isopentane Disproportionation

Developed a simple kinetic framework for evaluating catalyst hydride transfer ability.
( Read More )
TTO Director Austin Brown stands with awardees Dongping Lu (left) and Yong Wang (right).
JUNE 9, 2026
Staff Accomplishment

PNNL Transportation Researchers Win Two Department of Energy Awards

The Department of Energy’s Transportation Technologies Office has issued two 2026 Annual Merit Review Awards to researchers from PNNL. Both awards recognize PNNL researchers whose work is reducing the need for critical materials.
( Read More )
Illustration of molecular precession of carbon dioxide through a boron nitride nanotube
JUNE 4, 2026
Research Highlight

Direction-Specific Diffusion Enhances Gas Separations

Chiral nanotubes facilitate the direction-specific diffusion of carbon dioxide to be faster than nitrogen gas.
( Read More )
A smiling man in a lab setting
MAY 27, 2026
News Release

AI Speeds Selective and High-Yield Recovery of Critical Minerals from Industrial Waste

Critical minerals could be sourced from industrial waste at scale thanks to an AI-guided separation workflow developed by researchers at PNNL.
( Read More )
Photograph of Hsin-Mei Kao receiving an award certificate
MAY 15, 2026
Staff Accomplishment

Hsin-Mei Kao Wins Best Poster Award

Graduate student researcher wins best poster awards from the American Ceramic Society.
( Read More )
an abstract representation of a quantum computing problem being solved
APRIL 23, 2026
News Release

AI Accelerators Deliver Accurate Models for Challenging Quantum Chemistry Calculations

An international research team deployed AI-powered computing to solve important chemical structures for energy applications using NVIDIA hardware.
( Read More )
Illustration of a light cavity as opera glasses
APRIL 2, 2026
Research Highlight

Advancing Predictive Theories for Cavity-Modulated Molecular Systems

A suite of new modeling methods gives researchers better tools to predict molecular behavior inside cavities.
( Read More )
Illustration showing cobalt growth on mineral surfaces
APRIL 2, 2026
Research Highlight

Substrate Structure Influences Critical Mineral Availability in Shallow Subsurface Environments

The underlying crystal structure of carbonate surfaces plays a key role in the formation of cobalt mineral structures on these surfaces.
( Read More )
Photograph of a man, holding a glass jar in a laboratory
MARCH 24, 2026
Article

Extracting the Critical Mineral Nickel with Waste Acid

Replacing commercial acid with acidic waste enables researchers to improve nickel extraction efficiency, lower projected costs, and improve process economics.
( Read More )
Nanoribbon assembly
MARCH 16, 2026
News Release

Protein Design Principles Revealed in AI Analysis of Nanoribbon Assembly

An AI program called AtomAI helped PNNL researchers reveal key design principles for protein interfaces with mineral surfaces.
( Read More )
A researcher with a control device standing behind a robotic arm holding a lab sample tray.
MARCH 10, 2026
Feature

Autonomy Accelerates Science on a National Scale

Autonomous science laboratories are taking shape quickly across the PNNL campus.
( Read More )
Illustration showing polymer and substrate binding
FEBRUARY 25, 2026
Research Highlight

Interlayer Design for Orientational Control During Electrodeposition

Researchers discovered that a polymer additive promotes smooth, layer-by-layer deposition on metal electrodes by tuning interactions with the substrate.
( Read More )
Four panels of electron microscopy images
FEBRUARY 20, 2026
Research Highlight

Controlling Hierarchical Structures via Competitive Ion Adsorption

Anisotropies in surface potential driven by competitive ion adsorption can alter facet selectivity during oriented attachment.
( Read More )
Composite image of six portrait photos of PNNL researchers
FEBRUARY 20, 2026
News Release

Six PNNL Researchers Win DOE Early Career Research Awards

From exploring the development of transformative materials to strengthening biotechnology, six up-and-coming PNNL scientists were recognized for their scientific vision and prowess.
( Read More )
person holding a computer
FEBRUARY 17, 2026
News Release

PNNL Powers Biotechnology, Grid Operations, Nuclear Science Through Genesis AI for Science Mission

PNNL is central to the Genesis Mission, leading and participating in projects central to the nation’s security and international competitiveness.
( Read More )
DOE Secretary Chris Wright wearing safety glasses
FEBRUARY 2, 2026
Article

Secretary Wright Celebrates Scientific Innovation at Pacific Northwest National Laboratory 

Secretary Wright visited PNNL's campus in Richland, Washington, late last year to meet with innovators in chemistry, biology, computing, and more.
( Read More )
Figure showing protein-material hybrids forming with multiple panels of electron microscope images and simulations of the process
JANUARY 16, 2026
Article

Designing Protein-Material Interfaces

Summarizing the state of designed protein hybrid materials, researchers celebrate both the 50th anniversary of the MRS Bulletin and the 2025 Fred Kavli Distinguished Lecturers in Materials Science, Jim De Yoreo and David Baker.
( Read More )
Photograph of Giovanna Ricchiuti adjusting a Mach–Zehnder interferometer
JANUARY 9, 2026
Research Highlight

Local Magnetic Field Gradients Enable Critical Material Separations

Localized gradients in magnetic fields have long-range effects on the concentration of rare earth ions in solution, facilitating field-driven extraction of critical minerals.
( Read More )
Two side by side photographs of vials with nearby magnets, showing the difference in magnetic attraction for different solids
JANUARY 9, 2026
Research Highlight

Critical Mineral Compounds Respond Differently to Magnets

Studying a series of rare earth element compounds revealed differences in their magnetic behavior that will be leveraged for separations.
( Read More )
gibbsite crystal formation
JANUARY 5, 2026
News Release

Discoveries Rewrite How Some Minerals Form and Dissolve

Mystery of how important aluminum minerals form and dissolve solved with materials science and advanced imaging studies.
( Read More )
close up TEM of mesocrystal made of nanoplatelets
DECEMBER 30, 2025
Research Highlight

Growing Mesocrystals Through Nanoplatelet Oriented Sliding and Attachment

Nanosize platelets of an aluminum material slide and join in a staggered orientation to form larger crystals.
( Read More )
Joint Appointment Yong Wang
DECEMBER 19, 2025
Staff Accomplishment

Yong Wang Appointed Director of Institute for Integrated Catalysis

Yong Wang will lead the Institute for Integrated Catalysis, advancing the science and technology of catalysis to address global challenges in energy resilience.
( Read More )
Renyu Zheng giving an award presentation
DECEMBER 19, 2025
Staff Accomplishment

Zheng Receives Faculty Lecture Award

Researcher and graduate student Renyu Zheng selected for premier research recognition from the University of Washington Chemical Engineering Department.
( Read More )
Composite image with headshots of four researchers and institutional logos of IDREAM partners
DECEMBER 17, 2025
Staff Accomplishment

IDREAM Researchers Win Team Science Award

Early career researchers recognized with Team Science Award by the Department of Energy for presentation highlighting the collaborative science performed by IDREAM.
( Read More )
Niri Govind
DECEMBER 10, 2025
Staff Accomplishment

Govind to Lead New SciDAC Partnership

The Department of Energy, Basic Energy Sciences and Advanced Scientific Computing Research programs will support the partnership’s work on nuclear quantum behavior.
( Read More )
Illustration showing the ADAPT VQE approach
NOVEMBER 21, 2025
Research Highlight

Increasing Simulation Accuracy for Quantum Computing

An approach combining multiple theories increases the accuracy of quantum-based simulations without increasing computational demands.
( Read More )
Illustration showing a visual representation of peptoid molecules disrupting the water layer on a mineral surface and reacting with CO2
NOVEMBER 21, 2025
Research Highlight

Enzyme-Mimic Peptoids Accelerate Calcite Growth Kinetics

Specially designed histidine-containing peptoids mimic carbonic anhydrase to accelerate calcite step growth.
( Read More )
Illustration showing dimers leaving a mineral surface
NOVEMBER 21, 2025
Research Highlight

Bridging Molecular and Macroscale Controls of Mineral Dissolution

IDREAM researchers uncovered how dimeric complexes control how aluminum hydroxide minerals dissolve.
( Read More )
Illustration of PVC upcycling cycle
NOVEMBER 18, 2025
Research Highlight

Integrated Low-Temperature PVC and Polyolefin Upgrading

A low-temperature, single-stage catalytic process converts PVC and polyolefin into valuable alkanes.
( Read More )
Photograph close up of the faces of four researchers standing in front of an NMR
NOVEMBER 18, 2025
Research Highlight

Directly Probing Plutonium by Pu-239 Magnetic Resonance

A team independently verified solid-state plutonium signal in nuclear magnetic resonance spectroscopy and acquired new fundamental insights of the physics and chemistry of plutonium dioxide.
( Read More )
figure showing a simulation of molecules in a pore
NOVEMBER 18, 2025
Research Highlight

Articulating the Breakdown of Continuum Descriptions of Nanoconfined Fluid Flows

Scientists provide a guide for the rational application of continuum descriptions of fluid flows based on interfacial chemistry.
( Read More )
Electron microscopy image of two nanoparticles
NOVEMBER 18, 2025
Research Highlight

Grain Boundaries Accelerate Hydrogen Insertion into Palladium Nanostructures

Hydrogen preferentially inserts at grain boundaries between interconnected chains of palladium nanoparticles, which have a lower energy barrier for hydrogen incorporation into the material.
( Read More )
An image showing the autonomous experimentation cycle, with photographs of the robotic components
SEPTEMBER 30, 2025
Article

Autonomous Synthesis for Redox Flow Batteries

A closed-loop workflow brings together digital and physical frameworks to advance high-throughput experimentation on redox-active molecules in flow batteries.
( Read More )
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