As new paradigms in advanced computing take shape, computational chemistry researchers are finding new ways to solve challenging chemistry problems.

PNNL officials travel to Cyprus as subject matter experts and trainers for U.S. State Department Export Control and Border Security Program.

Researchers created the first open-source database of exotic materials eyed for use in quantum applications.

New PNNL research makes it easier to differentiate between chemical and nuclear explosions.

PNNL researchers use machine learning and data analytics to assist with detection of nuclear proliferation and nuclear material trafficking.

A new testbed facility capable of testing superconducting qubit fidelity in a controlled environment free of stray background radiation will benefit quantum information sciences and the development of quantum computing.

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.

Focused research studies of advanced algorithms and materials are setting the stage for the next generation of quantum computers.

High-performance imaging provides a cornerstone for innovation at the Energy Sciences Center opening at PNNL.

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 combines AI and cloud computing with damage assessment tool to predict path of wildfires and quickly evaluate the impact of natural disasters, giving first responders an upper hand.

The DOE Early Career Research Program supports exceptional researchers during the crucial early years of their careers and helps advance scientific discovery in fundamental sciences

In the face of the COVID-19 pandemic, PNNL pivoted to online learning approaches to conduct critical national security training across the globe.

With quantum chemistry, researchers led by PNNL computational scientist Simone Raugei are discovering how enzymes such as nitrogenase serve as natural catalysts that efficiently break apart molecular bonds to control energy and matter.

Sentry-SECURE is a new communication and response platform developed by PNNL, VPI, and Microsoft Azure that rapidly and securely transfers radiological alarm data through the cloud.

PNNL designed a free, web-based tool to visually explore the National Response Framework.

New 140,000-square-foot facility will advance fundamental chemistry and materials science for higher-performing, cost-effective catalysts and batteries, and other energy efficiency technologies.

As the COVID-19 pandemic continues, PNNL is offering support to its neighbors in the Mid-Columbia region and across Washington State.

Connected moments math shortcut shaves time and cost of quantum calculations while maintaining accuracy.

Special issue highlights PNNL contributions to NWChem and CP2K, two prominent software packages for computational chemistry.