PNNL researchers have published their paper “Introducing Molecular Hypernetworks for Discovery in Multidimensional Metabolomics Data” in the Journal of Proteome Research.

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

The Center for Continuum Computing at PNNL aims to integrate cloud platforms, high-performance computing, and edge devices into a seamless ecosystem that accelerates scientific discovery.

John VerWey, an advisor in the Mission Alignment group at PNNL, has recently been selected to lead a panel discussion at the inaugural Special Competitive Studies Project (SCSP) AI+ Compute & Connectivity Summit.

The Resilience Analysis Specialty Group is part of the Society for Risk Analysis, the premier international society for risk analysis professionals.

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.

Formal mathematics both reveals what’s inside the black box of AI algorithms and pushes the boundary of what’s possible within math as a discipline.

PNNL's “co-scientist” serves as a one-stop AI shop for accelerating scientific discovery. By leveraging AI agents, researchers can explore scientific databases, conduct analyses and request step-by-step plans for testing their hypotheses.

Researchers can now quantify uncertainty in trained AI models aimed at solving difficult chemistry, biology and materials science problems.

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.

By combining computational modeling with experimental research, scientists identified a promising composition that reduces the need for a critical material in an alloy that can withstand extreme environments.

Chromium cations better adapt to changes in oxygen stoichiometry than iron cations.

CACTUS provides AI-powered cheminformatics for autonomous science.

PNNL’s Center for Cloud Computing is addressing challenges in data management and hybrid cloud solutions with industry and academic partnerships.

EZBattery Model allows energy storage researchers to more quickly and easily identify the best performing battery designs without the need for extensive physical prototyping or computationally expensive simulations.

A new generation of microelectronics research begins at PNNL.

Using interfacial charge transfer to control cation charges in oxide superlattices offers insights for designing functional heterostructures.

His expertise in data science and commitment to open science will drive dataset dissemination and advance collaborative global research efforts.

Calcium carbonate mineralization occurs through a multi-step process that begins with a dense liquid phase.

Federal environmental permitting process to be fast-tracked with AI-powered tools and cloud-supported data analysis.