Advances in understanding the nature of the chemical bond are featured in this special issue of The Journal of Chemical Physics.

Xantheas was one of four professors in 2021/2022 to be selected by the Göttingen Academy of Sciences and Humanities for this award.

A combined experimental and computational approach showed that the hydration shell of hydroxide has a four-coordinate binding.

The Department of Energy has issued updated energy conservation standards for manufactured homes. The effort to establish the standards, supported by PNNL, is expected to result in a range of benefits for the manufactured housing sector.

New research makes molecular-level calculations of water faster and easier.

New research shows that compressing quantum circuits decreases noise and increases the accuracy of quantum calculations.

PNNL’s Reid Hart and Bing Liu have earned individual Champions of Energy Efficiency in Buildings awards from the American Council for an Energy-Efficient Economy.

PNNL worked with the Department of Energy on the Commercial Packaged Boiler rule, which will help reduce energy use, enhance the environment, and save dollars.

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.

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

Michael Brambley, a mechanical engineer at PNNL, receives ASHRAE Exceptional Service Award.

Srinivas Katipamula, a staff scientist at PNNL, has been honored with an ASHRAE Exceptional Service Award.

Xantheas awarded a visiting fellowship from the International Center for Advanced Studies of Energy Conversion in Germany.

Structural changes in heavy water occur at different temperatures than in standard water.

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

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

A comprehensive understanding of the electronic structure of uranyl ions provides insight into the chemistry of nuclear waste and uranium separation technologies.

Researchers achieved the complete assignment of the infrared spectrum of a hydronium-water “magic number” cluster reported in Science in 2004.

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.

Researchers at PNNL examined heat pump water heater (HPWH) operation in Pacific Northwest residences, gaining insights into HPWH electricity use patterns. Part of the study captured trends during a COVID-19 stay-at-home order.