Highly precise and controllable single-atom catalysts are affected by reaction conditions, which can alter the bonding around the atoms and the activity.

Chemical Engineer Yong Wang explains the influence and opportunity for joint appointments. Wang maintains one of the longest joint appointment tenures at PNNL.

Computational chemistry libraries from NWChem, NWChemEX, SPEC, and more are now available on Azure Quantum Elements.

PNNL scientists investigate the promising properties of a common, Earth-abundant salt.

PNNL researchers outline open problems in different scientific areas in the Journal of Combinatorics.

Water affects the intermediates present on the surface of a metal oxide catalyst during ketonization.

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

PNNL-developed catalytic process and catalyst to upgrade ethanol to sustainable aviation fuel wins American Chemical Society award.

PNNL welcomes new joint appointments to expand the research productivity and scientific impact of both PNNL and the university partners, broadening the base of expertise at each institution and helping to build interdisciplinary teams.

Newly developed models can help rapidly optimize systems to meet the need for rapidly deployable commercial carbon capture.

A new system can convert common plastics into valuable fuel molecules.

A new method to convert waste plastic to fuel and raw materials promises to help close the carbon cycle at mild temperature and with high yield.

Within zeolite pores, rates of alcohol dehydration increase with ionic strength until reaching a maximum and then decreasing.

Wendy Shaw begins an initial two-year term on the Advisory Board of Chemical Society Reviews.

Samantha Erwin was one of six speakers during the Careers Using Mathematics panel at the Nebraska Conference for Undergraduate Women in Mathematics.

The work by the team at PNNL takes a critical step in leveraging ML to accelerate advanced manufacturing R&D, specifically for manufacturing techniques without access to efficient, first-principles simulations.

In a water-containing system, the open circuit potential stabilizes positively charged species and lowers the energy barrier of the reaction.

Radha Kishan Motkuri lends skill and knowledge to co-lead special edition journal.

Johannes Lercher receives award from the North American Catalysis Society and the European Federation of Catalysis Societies.

PNNL scientists carve a path to profit from carbon capture by creating a system that efficiently captures CO2 and converts it into one of the world’s most widely used chemicals: methanol.