Tim brings a lot of expertise in TDDFT and modeling solvation from his Ph.D. experience with Peter Haynes at Imperial College and a post-doc with Mike Payne at the University of Cambridge. Welcome Tim...
Each year, the company Silicon Mechanics has a competition for the award of a high-performance computing cluster, including lots of memory, fast disk, and the latest GPUs. This year, Christine's...
At the ACS meeting in San Diego, Christine was presented with the ACS Open Eye Outstanding Junior Faculty Award in Computational Chemistry. Woo! This included a fabulous sushi dinner at Nobu and an...
Here we expand our studies of the size-dependent IP error to examine solution phase systems. We find that the IP error for non-exact exchange functionals is substantial in explicit solvent. For more...