IDREAM research shows that keeping only the most important two- and three-body terms in reactive force fields can decrease computational cost by one order of magnitude, while preserving satisfactory accuracy.
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.